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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2021-09-14 15:44:44 UTC

HMDB ID

HMDB0000994

Secondary Accession Numbers

HMDB00994

Metabolite Identification

Common Name

Dolichyl phosphate D-mannose

Description

Dolichyl phosphate D-mannose (DPM) is an intermediate in the biosynthesis of N-glycans. It is a substrate for dolichol-phosphate mannosyltransferase (PMID: 10835346 ). Dolichol-phosphate mannosyltransferase is a heterotrimeric protein embedded in the endoplasmic reticulum membrane. The first subunit of the heterotrimer appears to be the actual catalyst, and the other two subunits appear to stabilize it. More specifically, dolichol-phosphate-mannose is the donor of mannose groups in the synthesis of the dolichol pyrophosphate-linked precursor oligosaccharide in asparagine-linked glycosylation, in the synthesis of glycosyl phosphatidylinositol (GPI) anchor precursors, in protein O-mannosylation and in protein C-mannosylation. Its synthesis proceeds in two steps. First, cytosolic GDP-mannose reacts with dolichol phosphate exposed on the cytosolic face of the endoplasmic reticulum membrane to form DPM with its mannose moiety oriented toward the cytosol. The DPM molecule then flips in the endoplasmic reticulum membrane, so that its mannose moiety is in the endoplasmic reticulum lumen, accessible to the enzymes that catalyze its transfer to growing glycolipids and glycoproteins. (PMID: 11102867 ). Dolichyl phosphate D-mannose is also a substrate for protein O-mannosyl-transferase 2 and protein O-mannosyl-transferase 1.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

HMDB0000994
     RDKit          3D
Dolichyl phosphate D-mannose
 29 29  0  0  0  0  0  0  0  0999 V2000
    2.7972   -1.1271    1.9501 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1433   -1.0858    0.5057 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.6632   -2.6393    0.0454 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4591   -0.0373    0.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8974   -0.6410   -0.5003 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8237   -0.0391    0.1836 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.2698   -0.8464   -0.0216 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4443   -0.3737    0.5166 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.4964   -1.4543    0.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6735   -1.7379   -1.0252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8124    0.8967   -0.2128 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0039    1.4401    0.1853 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7107    1.9060    0.1335 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.9764    3.1387   -0.4072 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6008    1.3532   -0.3369 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5719    1.3260   -1.7432 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9055   -3.2926    0.0593 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0235   -0.4165   -0.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    0.0288    1.2674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2978   -0.1191    1.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4772   -1.1524    0.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0968   -2.3695    0.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0202   -2.4078   -1.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.6944   -1.2949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7807    0.8523    0.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281    2.0038    1.2458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1898    3.6820   -0.5892 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3982    2.0351   -0.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446    0.3829   -2.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  1
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  6
 12 25  1  0
 13 26  1  1
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

HMDB00994.mol
  Mrv0541 02231218512D          

 16 16  0  0  0  0            999 V2000
   -0.7136   -0.1512    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7136   -0.9762    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0014   -1.3887    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7150   -0.9762    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7150   -0.1512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2612    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4300   -1.3887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286   -1.3887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286    0.2612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4300   -2.2137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0014   -2.2137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7136    1.4987    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3011    2.2137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286    1.9112    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1261    0.7837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  4  7  1  6  0  0  0
  2  8  1  6  0  0  0
  1  9  1  6  0  0  0
  6 10  1  6  0  0  0
  7 11  1  0  0  0  0
  3 12  1  1  0  0  0
 10 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0000994

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@H]1O[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6+/m1/s1

> <INCHI_KEY>
HXXFSFRBOHSIMQ-PQMKYFCFSA-N

> <FORMULA>
C6H13O9P

> <MOLECULAR_WEIGHT>
260.1358

> <EXACT_MASS>
260.029718526

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_AVERAGE_POLARIZABILITY>
20.32920124346633

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonic acid

> <ALOGPS_LOGP>
-2.00

> <JCHEM_LOGP>
-3.056105249333333

> <ALOGPS_LOGS>
-0.91

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.2188934582423325

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.1553718480897146

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9810995814615806

> <JCHEM_POLAR_SURFACE_AREA>
156.91

> <JCHEM_REFRACTIVITY>
46.796299999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.23e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
dolichyl phosphate D-mannose

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0000994
     RDKit          3D
Dolichyl phosphate D-mannose
 29 29  0  0  0  0  0  0  0  0999 V2000
    2.7972   -1.1271    1.9501 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1433   -1.0858    0.5057 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.6632   -2.6393    0.0454 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4591   -0.0373    0.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8974   -0.6410   -0.5003 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8237   -0.0391    0.1836 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.2698   -0.8464   -0.0216 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4443   -0.3737    0.5166 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.4964   -1.4543    0.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6735   -1.7379   -1.0252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8124    0.8967   -0.2128 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0039    1.4401    0.1853 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7107    1.9060    0.1335 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.9764    3.1387   -0.4072 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6008    1.3532   -0.3369 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5719    1.3260   -1.7432 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9055   -3.2926    0.0593 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0235   -0.4165   -0.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    0.0288    1.2674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2978   -0.1191    1.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4772   -1.1524    0.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0968   -2.3695    0.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0202   -2.4078   -1.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.6944   -1.2949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7807    0.8523    0.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281    2.0038    1.2458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1898    3.6820   -0.5892 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3982    2.0351   -0.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446    0.3829   -2.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  1
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  6
 12 25  1  0
 13 26  1  1
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: HMDB00994.mol                                     
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0      -1.332  -0.282   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -1.332  -1.822   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       0.003  -2.592   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.335  -1.822   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       1.335  -0.282   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0       0.000   0.488   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       2.669  -2.592   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -2.667  -2.592   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      -2.667   0.488   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0       0.000   2.028   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0       2.669  -4.132   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0       0.003  -4.132   0.000  0.00  0.00           O+0
HETATM   13  P   UNK     0      -1.332   2.798   0.000  0.00  0.00           P+0
HETATM   14  O   UNK     0      -0.562   4.132   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0      -2.667   3.568   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -2.102   1.463   0.000  0.00  0.00           O+0
CONECT    1    2    6    9                                                  
CONECT    2    1    3    8                                                  
CONECT    3    2    4   12                                                  
CONECT    4    3    5    7                                                  
CONECT    5    4    6                                                       
CONECT    6    5    1   10                                                  
CONECT    7    4   11                                                       
CONECT    8    2                                                            
CONECT    9    1                                                            
CONECT   10    6   13                                                       
CONECT   11    7                                                            
CONECT   12    3                                                            
CONECT   13   10   14   15   16                                             
CONECT   14   13                                                            
CONECT   15   13                                                            
CONECT   16   13                                                            
MASTER        0    0    0    0    0    0    0    0   16    0   32    0
END

COMPND    HMDB0000994
HETATM    1  O1  UNL     1       2.797  -1.127   1.950  1.00  0.00           O  
HETATM    2  P1  UNL     1       3.143  -1.086   0.506  1.00  0.00           P  
HETATM    3  O2  UNL     1       3.663  -2.639   0.045  1.00  0.00           O  
HETATM    4  O3  UNL     1       4.459  -0.037   0.196  1.00  0.00           O  
HETATM    5  O4  UNL     1       1.897  -0.641  -0.500  1.00  0.00           O  
HETATM    6  C1  UNL     1       0.824  -0.039   0.184  1.00  0.00           C  
HETATM    7  O5  UNL     1      -0.270  -0.846  -0.022  1.00  0.00           O  
HETATM    8  C2  UNL     1      -1.444  -0.374   0.517  1.00  0.00           C  
HETATM    9  C3  UNL     1      -2.496  -1.454   0.328  1.00  0.00           C  
HETATM   10  O6  UNL     1      -2.673  -1.738  -1.025  1.00  0.00           O  
HETATM   11  C4  UNL     1      -1.812   0.897  -0.213  1.00  0.00           C  
HETATM   12  O7  UNL     1      -3.004   1.440   0.185  1.00  0.00           O  
HETATM   13  C5  UNL     1      -0.711   1.906   0.133  1.00  0.00           C  
HETATM   14  O8  UNL     1      -0.976   3.139  -0.407  1.00  0.00           O  
HETATM   15  C6  UNL     1       0.601   1.353  -0.337  1.00  0.00           C  
HETATM   16  O9  UNL     1       0.572   1.326  -1.743  1.00  0.00           O  
HETATM   17  H1  UNL     1       2.906  -3.293   0.059  1.00  0.00           H  
HETATM   18  H2  UNL     1       5.023  -0.417  -0.537  1.00  0.00           H  
HETATM   19  H3  UNL     1       1.005   0.029   1.267  1.00  0.00           H  
HETATM   20  H4  UNL     1      -1.298  -0.119   1.569  1.00  0.00           H  
HETATM   21  H5  UNL     1      -3.477  -1.152   0.730  1.00  0.00           H  
HETATM   22  H6  UNL     1      -2.097  -2.370   0.818  1.00  0.00           H  
HETATM   23  H7  UNL     1      -2.020  -2.408  -1.355  1.00  0.00           H  
HETATM   24  H8  UNL     1      -1.756   0.694  -1.295  1.00  0.00           H  
HETATM   25  H9  UNL     1      -3.781   0.852   0.094  1.00  0.00           H  
HETATM   26  H10 UNL     1      -0.728   2.004   1.246  1.00  0.00           H  
HETATM   27  H11 UNL     1      -0.190   3.682  -0.589  1.00  0.00           H  
HETATM   28  H12 UNL     1       1.398   2.035  -0.038  1.00  0.00           H  
HETATM   29  H13 UNL     1       0.445   0.383  -2.060  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4    5
CONECT    3   17
CONECT    4   18
CONECT    5    6
CONECT    6    7   15   19
CONECT    7    8
CONECT    8    9   11   20
CONECT    9   10   21   22
CONECT   10   23
CONECT   11   12   13   24
CONECT   12   25
CONECT   13   14   15   26
CONECT   14   27
CONECT   15   16   28
CONECT   16   29
END

HMDB0000994
     RDKit          3D
Dolichyl phosphate D-mannose
 29 29  0  0  0  0  0  0  0  0999 V2000
    2.7972   -1.1271    1.9501 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1433   -1.0858    0.5057 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.6632   -2.6393    0.0454 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4591   -0.0373    0.1959 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8974   -0.6410   -0.5003 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8237   -0.0391    0.1836 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.2698   -0.8464   -0.0216 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4443   -0.3737    0.5166 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.4964   -1.4543    0.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6735   -1.7379   -1.0252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8124    0.8967   -0.2128 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0039    1.4401    0.1853 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7107    1.9060    0.1335 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.9764    3.1387   -0.4072 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6008    1.3532   -0.3369 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5719    1.3260   -1.7432 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9055   -3.2926    0.0593 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0235   -0.4165   -0.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    0.0288    1.2674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2978   -0.1191    1.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4772   -1.1524    0.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0968   -2.3695    0.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0202   -2.4078   -1.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.6944   -1.2949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7807    0.8523    0.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281    2.0038    1.2458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1898    3.6820   -0.5892 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3982    2.0351   -0.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446    0.3829   -2.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  1
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  6
 12 25  1  0
 13 26  1  1
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Dolichyl phosphoric acid D-mannose	Generator
Dolichol phosphate mannose	HMDB
Dolichyl D-mannosyl phosphate	HMDB
DPM	HMDB
{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonate	HMDB

Chemical Formula

C₆H₁₃O₉P

Average Molecular Weight

260.1358

Monoisotopic Molecular Weight

260.029718526

IUPAC Name

{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonic acid

Traditional Name

dolichyl phosphate D-mannose

CAS Registry Number

908211-94-9

SMILES

OC[C@H]1O[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O

InChI Identifier

InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6+/m1/s1

InChI Key

HXXFSFRBOHSIMQ-PQMKYFCFSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Monosaccharide phosphates

Alternative Parents

Substituents

Hexose monosaccharide
Monosaccharide phosphate
Monoalkyl phosphate
Organic phosphoric acid derivative
Oxane
Alkyl phosphate
Phosphoric acid ester
Secondary alcohol
Oxacycle
Organoheterocyclic compound
Polyol
Alcohol
Hydrocarbon derivative
Primary alcohol
Organic oxide
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Endogenous (HMDB: HMDB0000994)

Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)
Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)

Equine

Horse (FooDB: FOOD00378)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	32.3 g/L	ALOGPS
logP	-2	ALOGPS
logP	-3.1	ChemAxon
logS	-0.91	ALOGPS
pKa (Strongest Acidic)	1.16	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	156.91 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	46.8 m³·mol⁻¹	ChemAxon
Polarizability	20.33 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	155.031	31661259
DarkChem	[M-H]-	148.825	31661259
AllCCS	[M+H]+	156.816	32859911
AllCCS	[M-H]-	146.166	32859911
DeepCCS	[M+H]+	142.301	30932474
DeepCCS	[M-H]-	139.906	30932474
DeepCCS	[M-2H]-	174.621	30932474
DeepCCS	[M+Na]+	149.194	30932474
AllCCS	[M+H]+	156.8	32859911
AllCCS	[M+H-H2O]+	153.2	32859911
AllCCS	[M+NH4]+	160.2	32859911
AllCCS	[M+Na]+	161.2	32859911
AllCCS	[M-H]-	146.2	32859911
AllCCS	[M+Na-2H]-	146.5	32859911
AllCCS	[M+HCOO]-	146.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Dolichyl phosphate D-mannose	OC[C@H]1O[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O	2971.1	Standard polar	33892256
Dolichyl phosphate D-mannose	OC[C@H]1O[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O	2204.1	Standard non polar	33892256
Dolichyl phosphate D-mannose	OC[C@H]1O[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O	2241.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Dolichyl phosphate D-mannose,1TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O	2170.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O	2110.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)O[C@H](CO)[C@H]1O	2104.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1O	2113.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	2173.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2119.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1O	2153.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	2194.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2122.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2132.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O	2188.9	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	2086.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	2110.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	2162.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)O[C@H](CO)[C@H]1O[Si](C)(C)C	2096.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@H]1O	2160.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2124.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	2119.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	2116.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@H]1O[Si](C)(C)C	2119.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@H]1O	2124.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	2105.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2123.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2104.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2118.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2119.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2103.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O	2126.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2126.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	2120.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2139.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	2190.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@H]1O[Si](C)(C)C	2185.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2159.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2162.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2128.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2155.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2171.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2127.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2169.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	2186.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2170.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2203.3	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2588.2	Standard polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2183.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2240.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2518.6	Standard polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2180.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2251.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2484.5	Standard polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2178.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2242.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2494.6	Standard polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2194.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2213.5	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2475.5	Standard polar	33892256
Dolichyl phosphate D-mannose,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2220.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2279.1	Standard non polar	33892256
Dolichyl phosphate D-mannose,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2440.7	Standard polar	33892256
Dolichyl phosphate D-mannose,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O	2416.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O	2388.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)O[C@H](CO)[C@H]1O	2386.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1O	2388.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	2422.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2562.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	2606.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	2629.9	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2576.9	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2571.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O	2631.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2549.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2561.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	2612.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)O[C@H](CO)[C@H]1O[Si](C)(C)C(C)(C)C	2552.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@H]1O	2606.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2757.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2767.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	2777.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@H]1O[Si](C)(C)C(C)(C)C	2754.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@H]1O	2776.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	2764.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2759.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2785.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2741.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2784.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2775.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O	2788.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2745.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2762.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2970.8	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2974.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@H]1O[Si](C)(C)C(C)(C)C	2971.3	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2974.6	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2976.5	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2970.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2970.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2972.7	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2958.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2971.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2977.4	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3192.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3106.6	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3022.0	Standard polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3184.1	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3104.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2980.3	Standard polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3185.9	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3118.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2953.5	Standard polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3177.0	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3102.5	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2965.1	Standard polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3186.2	Semi standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3085.0	Standard non polar	33892256
Dolichyl phosphate D-mannose,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2943.0	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (Non-derivatized) - 70eV, Positive	splash10-0002-9320000000-a09e98e90da0a3c66173	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (4 TMS) - 70eV, Positive	splash10-003u-3892380000-6f3044d9c3f952cf4b44	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_1) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_2) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_3) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_4) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_5) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Dolichyl phosphate D-mannose GC-MS (TMS_3_6) - 70eV, Positive	Not Available	2021-11-06	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 10V, Positive-QTOF	splash10-0002-9130000000-0173720981b7b1d7a5d8	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 20V, Positive-QTOF	splash10-0002-9240000000-d27275e74b0283c592dc	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 40V, Positive-QTOF	splash10-0002-9100000000-8389331fb0da3c617f2f	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 10V, Negative-QTOF	splash10-0a6s-8290000000-5d7e82085dc2e86c5bb7	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 20V, Negative-QTOF	splash10-004i-9010000000-03c6ff3c1e1b1a23255e	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 40V, Negative-QTOF	splash10-004i-9000000000-38e837f16bac5f0ceade	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 10V, Positive-QTOF	splash10-03di-0290000000-b59137504dd85ff7bcbf	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 20V, Positive-QTOF	splash10-03dj-5920000000-50b89ef6664d51ebdb62	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 40V, Positive-QTOF	splash10-0a4j-9000000000-448e77bbc693c887ac18	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 10V, Negative-QTOF	splash10-0a4i-3090000000-69c93c84647ca924108a	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 20V, Negative-QTOF	splash10-004i-9010000000-0d6df09e6f12d66f281c	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Dolichyl phosphate D-mannose 40V, Negative-QTOF	splash10-004i-9000000000-f53a8156649b945c2aee	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB022356

KNApSAcK ID

Not Available

Chemspider ID

2496902

KEGG Compound ID

C03862

BioCyc ID

Not Available

BiGG ID

1809321

Wikipedia Link

Not Available

METLIN ID

5925

PubChem Compound

3246168

PDB ID

Not Available

ChEBI ID

1220424

Food Biomarker Ontology

Not Available

VMH ID

DOLMANP_L

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Maeda Y, Tanaka S, Hino J, Kangawa K, Kinoshita T: Human dolichol-phosphate-mannose synthase consists of three subunits, DPM1, DPM2 and DPM3. EMBO J. 2000 Jun 1;19(11):2475-82. [PubMed:10835346 ]
Kinoshita T, Inoue N: Dissecting and manipulating the pathway for glycosylphos-phatidylinositol-anchor biosynthesis. Curr Opin Chem Biol. 2000 Dec;4(6):632-8. [PubMed:11102867 ]

Enzymes

Enzyme Details

1. Dolichol-phosphate mannosyltransferase

General function:: Cell wall/membrane/envelope biogenesis
Specific function:: Transfers mannose from GDP-mannose to dolichol monophosphate to form dolichol phosphate mannose (Dol-P-Man) which is the mannosyl donor in pathways leading to N-glycosylation, glycosyl phosphatidylinositol membrane anchoring, and O-mannosylation of proteins.
Gene Name:: DPM1
Uniprot ID:: O60762
Molecular weight:: 29633.995

Reactions

Guanosine diphosphate mannose + Dolichol-20 → Guanosine diphosphate + Dolichyl phosphate D-mannose	details

Enzyme Details

2. Protein O-mannosyl-transferase 1

General function:: Involved in mannosyltransferase activity
Specific function:: Transfers mannosyl residues to the hydroxyl group of serine or threonine residues. Coexpression of both POMT1 and POMT2 is necessary for enzyme activity, expression of either POMT1 or POMT2 alone is insufficient.
Gene Name:: POMT1
Uniprot ID:: Q9Y6A1
Molecular weight:: 82566.18

Reactions

Dolichyl phosphate D-mannose + protein → Dolichol-20 + O-D-mannosylprotein	details

Enzyme Details

3. Protein O-mannosyl-transferase 2

General function:: Involved in mannosyltransferase activity
Specific function:: Transfers mannosyl residues to the hydroxyl group of serine or threonine residues. Coexpression of both POMT1 and POMT2 is necessary for enzyme activity, expression of either POMT1 or POMT2 alone is insufficient.
Gene Name:: POMT2
Uniprot ID:: Q9UKY4
Molecular weight:: 84213.155

Reactions

Dolichyl phosphate D-mannose + protein → Dolichol-20 + O-D-mannosylprotein	details

Enzyme Details

4. Dol-P-Man:Man(5)GlcNAc(2)-PP-Dol alpha-1,3-mannosyltransferase

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: Adds the first Dol-P-Man derived mannose in an alpha-1,3 linkage to Man5GlcNAc2-PP-Dol.
Gene Name:: ALG3
Uniprot ID:: Q92685
Molecular weight:: 44369.995

Reactions

Dolichyl phosphate D-mannose + D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol → D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->3)-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol + Dolichol-20	details

Enzyme Details

5. Dol-P-Man:Man(7)GlcNAc(2)-PP-Dol alpha-1,6-mannosyltransferase

General function:: Not Available
Specific function:: Adds the eighth mannose residue in an alpha-1,6 linkage onto the dolichol-PP-oligosaccharide precursor (dolichol-PP-Man(7)GlcNAc(2)) required for protein glycosylation.
Gene Name:: ALG12
Uniprot ID:: Q9BV10
Molecular weight:: 54654.195

Reactions

Dolichyl phosphate D-mannose + D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol → D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->6))-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol + Dolichol-20	details

Enzyme Details

6. Alpha-1,2-mannosyltransferase ALG9

General function:: Not Available
Specific function:: Catalyzes the transfer of mannose from Dol-P-Man to lipid-linked oligosaccharides.
Gene Name:: ALG9
Uniprot ID:: Q9H6U8
Molecular weight:: 69862.66

Reactions

Dolichyl phosphate D-mannose + D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->3)-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol → D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol + Dolichol-20	details
Dolichyl phosphate D-mannose + D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->6))-D-Man-alpha-(1->6))-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol → D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-(D-Man-alpha-(1->2)-D-Man-alpha-(1->6))-D-Man-alpha-(1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol + Dolichol-20	details

Enzyme Details

7. Dolichol phosphate-mannose biosynthesis regulatory protein

General function:: Not Available
Specific function:: Regulates the biosynthesis of dolichol phosphate-mannose. Essential for the ER localization and stable expression of DPM1.
Gene Name:: DPM2
Uniprot ID:: O94777
Molecular weight:: Not Available

Reactions

Guanosine diphosphate mannose + Dolichol-20 → Guanosine diphosphate + Dolichyl phosphate D-mannose	details

Enzyme Details

8. Dolichol-phosphate mannosyltransferase subunit 3

General function:: Not Available
Specific function:: Stabilizer subunit of the dolichol-phosphate-mannose synthase complex.
Gene Name:: DPM3
Uniprot ID:: Q9P2X0
Molecular weight:: Not Available

Reactions

Guanosine diphosphate mannose + Dolichol-20 → Guanosine diphosphate + Dolichyl phosphate D-mannose	details

Showing metabocard for Dolichyl phosphate D-mannose (HMDB0000994)

MOL for HMDB0000994 (Dolichyl phosphate D-mannose)

3D MOL for HMDB0000994 (Dolichyl phosphate D-mannose)

3D SDF for HMDB0000994 (Dolichyl phosphate D-mannose)

3D-SDF for HMDB0000994 (Dolichyl phosphate D-mannose)

PDB for HMDB0000994 (Dolichyl phosphate D-mannose)

3D PDB for HMDB0000994 (Dolichyl phosphate D-mannose)

SMILES for HMDB0000994 (Dolichyl phosphate D-mannose)

INCHI for HMDB0000994 (Dolichyl phosphate D-mannose)

Structure for HMDB0000994 (Dolichyl phosphate D-mannose)

3D Structure for HMDB0000994 (Dolichyl phosphate D-mannose)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

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