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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (5) Show 5 proteins XML

Record Information

Version

5.0

Status

Detected and Quantified

Creation Date

2006-05-22 14:17:37 UTC

Update Date

2023-02-21 17:16:11 UTC

HMDB ID

HMDB0002127

Secondary Accession Numbers

HMDB02127

Metabolite Identification

Common Name

3-Mercaptolactic acid

Description

3-Mercaptolactic acid, also known as 3-mercaptolactate, belongs to the class of organic compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn. In humans, 3-mercaptolactic acid is involved in the cysteine metabolism pathway. 3-Mercaptolactic acid has been detected, but not quantified in, a few different foods, such as anatidaes (Anatidae), chickens (Gallus gallus), and domestic pigs (Sus scrofa domestica). This could make 3-mercaptolactic acid a potential biomarker for the consumption of these foods. 3-Mercaptolactic acid is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review very few articles have been published on 3-Mercaptolactic acid.

Structure

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

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
3-Mercaptolactate	Generator
b-Mercaptolactate	HMDB
b-Mercaptolactic acid	HMDB
beta-Mercaptolactate	HMDB, MeSH
beta-Mercaptolactic acid	HMDB
2-Hydroxy-3-mercaptopropionic acid	MeSH, HMDB

Chemical Formula

C₃H₆O₃S

Average Molecular Weight

122.143

Monoisotopic Molecular Weight

122.003764748

IUPAC Name

2-hydroxy-3-sulfanylpropanoic acid

Traditional Name

β-mercaptolactic acid

CAS Registry Number

2614-83-7

SMILES

OC(CS)C(O)=O

InChI Identifier

InChI=1S/C3H6O3S/c4-2(1-7)3(5)6/h2,4,7H,1H2,(H,5,6)

InChI Key

OLQOVQTWRIJPRE-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Monosaccharides

Alternative Parents

Substituents

Monosaccharide
Hydroxy acid
Alpha-hydroxy acid
Secondary alcohol
Monocarboxylic acid or derivatives
Carboxylic acid
Carboxylic acid derivative
Alkylthiol
Organic oxide
Hydrocarbon derivative
Organosulfur compound
Carbonyl group
Alcohol
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Urine (PMID: 6945862)

Cellular substructure

Cytoplasm (HMDB: HMDB0002127)

Source

Endogenous

Endogenous (HMDB: HMDB0002127)

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)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

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)

Equine

Horse (FooDB: FOOD00378)

Process

Naturally occurring process

Biological process

Biochemical pathway

Disease pathway

Cystinosis, Ocular Nonnephropathic (HMDB: HMDB0002127)
Beta-Mercaptolactate-Cysteine Disulfiduria (PathBank: SMP0120783)
Cystinosis, Ocular Nonnephropathic (PathBank: SMP0120654)

Metabolic pathway

Cysteine Metabolism (PathBank: SMP0063607)
Cysteine Metabolism (HMDB: HMDB0002127)

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	28.8 g/L	ALOGPS
logP	-0.33	ALOGPS
logP	-0.42	ChemAxon
logS	-0.63	ALOGPS
pKa (Strongest Acidic)	3.73	ChemAxon
pKa (Strongest Basic)	-3.9	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	57.53 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	26.57 m³·mol⁻¹	ChemAxon
Polarizability	10.98 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	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]+	123.29	31661259
DarkChem	[M-H]-	116.986	31661259
DeepCCS	[M+H]+	136.32	30932474
DeepCCS	[M-H]-	133.558	30932474
DeepCCS	[M-2H]-	170.0	30932474
DeepCCS	[M+Na]+	144.671	30932474
AllCCS	[M+H]+	130.3	32859911
AllCCS	[M+H-H2O]+	126.1	32859911
AllCCS	[M+NH4]+	134.1	32859911
AllCCS	[M+Na]+	135.3	32859911
AllCCS	[M-H]-	128.4	32859911
AllCCS	[M+Na-2H]-	132.3	32859911
AllCCS	[M+HCOO]-	136.7	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
3-Mercaptolactic acid	OC(CS)C(O)=O	2653.9	Standard polar	33892256
3-Mercaptolactic acid	OC(CS)C(O)=O	1194.2	Standard non polar	33892256
3-Mercaptolactic acid	OC(CS)C(O)=O	1219.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
3-Mercaptolactic acid,1TMS,isomer #1	C[Si](C)(C)OC(CS)C(=O)O	1288.3	Semi standard non polar	33892256
3-Mercaptolactic acid,1TMS,isomer #2	C[Si](C)(C)OC(=O)C(O)CS	1170.8	Semi standard non polar	33892256
3-Mercaptolactic acid,1TMS,isomer #3	C[Si](C)(C)SCC(O)C(=O)O	1330.4	Semi standard non polar	33892256
3-Mercaptolactic acid,2TMS,isomer #1	C[Si](C)(C)OC(=O)C(CS)O[Si](C)(C)C	1305.4	Semi standard non polar	33892256
3-Mercaptolactic acid,2TMS,isomer #2	C[Si](C)(C)OC(CS[Si](C)(C)C)C(=O)O	1450.0	Semi standard non polar	33892256
3-Mercaptolactic acid,2TMS,isomer #3	C[Si](C)(C)OC(=O)C(O)CS[Si](C)(C)C	1378.5	Semi standard non polar	33892256
3-Mercaptolactic acid,3TMS,isomer #1	C[Si](C)(C)OC(=O)C(CS[Si](C)(C)C)O[Si](C)(C)C	1493.1	Semi standard non polar	33892256
3-Mercaptolactic acid,3TMS,isomer #1	C[Si](C)(C)OC(=O)C(CS[Si](C)(C)C)O[Si](C)(C)C	1445.2	Standard non polar	33892256
3-Mercaptolactic acid,3TMS,isomer #1	C[Si](C)(C)OC(=O)C(CS[Si](C)(C)C)O[Si](C)(C)C	1456.2	Standard polar	33892256
3-Mercaptolactic acid,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(CS)C(=O)O	1537.4	Semi standard non polar	33892256
3-Mercaptolactic acid,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)C(O)CS	1423.1	Semi standard non polar	33892256
3-Mercaptolactic acid,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)SCC(O)C(=O)O	1565.2	Semi standard non polar	33892256
3-Mercaptolactic acid,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)C(CS)O[Si](C)(C)C(C)(C)C	1770.7	Semi standard non polar	33892256
3-Mercaptolactic acid,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(CS[Si](C)(C)C(C)(C)C)C(=O)O	1888.0	Semi standard non polar	33892256
3-Mercaptolactic acid,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)C(O)CS[Si](C)(C)C(C)(C)C	1839.8	Semi standard non polar	33892256
3-Mercaptolactic acid,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)C(CS[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2127.8	Semi standard non polar	33892256
3-Mercaptolactic acid,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)C(CS[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2106.8	Standard non polar	33892256
3-Mercaptolactic acid,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)C(CS[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	1914.7	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 3-Mercaptolactic acid GC-MS (Non-derivatized) - 70eV, Positive	splash10-002g-9000000000-ec302f4694b6fbe742e4	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 3-Mercaptolactic acid GC-MS (2 TMS) - 70eV, Positive	splash10-0101-6900000000-98313ee0ac74efcd81ec	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 3-Mercaptolactic acid GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	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 - 3-Mercaptolactic acid 10V, Positive-QTOF	splash10-0ab9-2900000000-55f12b41f09e42cb47fe	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 20V, Positive-QTOF	splash10-05i0-9800000000-5b40640f82765202a931	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 40V, Positive-QTOF	splash10-0a4i-9000000000-8d35c46555f8bdd847ad	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 10V, Negative-QTOF	splash10-00di-5900000000-c6cd293513c4793101fa	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 20V, Negative-QTOF	splash10-0fk9-6900000000-9ddf197cc5dea25f92f1	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 40V, Negative-QTOF	splash10-05cu-9000000000-ebb35603167a0fe7949e	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 10V, Negative-QTOF	splash10-00ei-9600000000-1bb94b127c625b0d2c7e	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 20V, Negative-QTOF	splash10-001i-9000000000-942ac689538269d6ca7b	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 40V, Negative-QTOF	splash10-001i-9000000000-942ac689538269d6ca7b	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 10V, Positive-QTOF	splash10-0a4i-9800000000-84ad16e616d5892fcac4	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 20V, Positive-QTOF	splash10-0a4i-9000000000-0d197946f5f3da97fbe6	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 3-Mercaptolactic acid 40V, Positive-QTOF	splash10-0a4i-9000000000-2facde427c58aeabdf38	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

IR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M-H]-)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+)	2023-02-03	FELIX lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Urine

Tissue Locations

Not Available

Pathways

Name	SMPDB/PathBank	KEGG
Cysteine Metabolism
Beta-mercaptolactate-cysteine disulfiduria		Not Available
Cystinosis, ocular nonnephropathic		Not Available

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Urine	Detected and Quantified	0.910-4.430 umol/mmol creatinine	Not Specified	Both	Normal	6945862	details

Abnormal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Urine	Detected and Quantified	58.7 umol/mmol creatinine	Adult (>18 years old)	Female	Beta-mercaptolactate-cysteine Disulfiduria	6945862	details

Associated Disorders and Diseases

Disease References

Beta-mercaptolactate-cysteine Disulfiduria
Hannestad U, Martensson J, Sjodahl R, Sorbo B: 3-mercaptolactate cysteine disulfiduria: biochemical studies on affected and unaffected members of a family. Biochem Med. 1981 Aug;26(1):106-14. [PubMed:6945862 ]

Associated OMIM IDs

249650 (Beta-mercaptolactate-cysteine Disulfiduria)

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB022856

KNApSAcK ID

Not Available

Chemspider ID

141158

KEGG Compound ID

C05823

BioCyc ID

Not Available

BiGG ID

46576

Wikipedia Link

Not Available

METLIN ID

6499

PubChem Compound

160645

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

MERCPLAC

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Costa, Mara; Pensa, Bernardo; Iavarone, Carlo; Cavallini, Doriano. Preparation of 3-mercaptolactic acid and S-aminoethylmercaptolactic acid. Preparative Biochemistry (1982), 12(5), 417-27.

Material Safety Data Sheet (MSDS)

Not Available

General References

Hannestad U, Sorbo B: Determination of 3-mercaptolactate, mercaptoacetate and N-acetylcysteine in urine by gas chromatography. Clin Chim Acta. 1979 Jul 16;95(2):189-200. [PubMed:527218 ]
Wronski M: Separation of urinary thiols as tributyltinmercaptides and determination using capillary isotachophoresis. J Chromatogr B Biomed Appl. 1996 Feb 9;676(1):29-34. [PubMed:8852041 ]

Enzymes

Enzyme Details

1. L-lactate dehydrogenase A-like 6A

General function:: Involved in oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
Specific function:: Displays an lactate dehydrogenase activity. Significantly increases the transcriptional activity of JUN, when overexpressed.
Gene Name:: LDHAL6A
Uniprot ID:: Q6ZMR3
Molecular weight:: 36507.015

Reactions

3-Mercaptolactic acid + NAD → 3-Mercaptopyruvic acid + NADH + Hydrogen Ion	details

Enzyme Details

2. L-lactate dehydrogenase B chain

General function:: Involved in oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
Specific function:: Not Available
Gene Name:: LDHB
Uniprot ID:: P07195
Molecular weight:: 36638.225

Reactions

3-Mercaptolactic acid + NAD → 3-Mercaptopyruvic acid + NADH + Hydrogen Ion	details

Enzyme Details

3. L-lactate dehydrogenase C chain

General function:: Involved in oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
Specific function:: Possible role in sperm motility.
Gene Name:: LDHC
Uniprot ID:: P07864
Molecular weight:: 36310.965

Reactions

3-Mercaptolactic acid + NAD → 3-Mercaptopyruvic acid + NADH + Hydrogen Ion	details

Enzyme Details

4. L-lactate dehydrogenase A chain

General function:: Involved in oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
Specific function:: Not Available
Gene Name:: LDHA
Uniprot ID:: P00338
Molecular weight:: 30204.975

Reactions

3-Mercaptolactic acid + NAD → 3-Mercaptopyruvic acid + NADH + Hydrogen Ion	details

Enzyme Details

5. L-lactate dehydrogenase A-like 6B

General function:: Involved in oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
Specific function:: Not Available
Gene Name:: LDHAL6B
Uniprot ID:: Q9BYZ2
Molecular weight:: 41942.53

Reactions

3-Mercaptolactic acid + NAD → 3-Mercaptopyruvic acid + NADH + Hydrogen Ion	details

Showing metabocard for 3-Mercaptolactic acid (HMDB0002127)

MOL for HMDB0002127 (3-Mercaptolactic acid)

3D MOL for HMDB0002127 (3-Mercaptolactic acid)

3D SDF for HMDB0002127 (3-Mercaptolactic acid)

3D-SDF for HMDB0002127 (3-Mercaptolactic acid)

PDB for HMDB0002127 (3-Mercaptolactic acid)

3D PDB for HMDB0002127 (3-Mercaptolactic acid)

SMILES for HMDB0002127 (3-Mercaptolactic acid)

INCHI for HMDB0002127 (3-Mercaptolactic acid)

Structure for HMDB0002127 (3-Mercaptolactic acid)

3D Structure for HMDB0002127 (3-Mercaptolactic acid)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

IR Spectra

Enzymes

Reactions

Reactions

Reactions

Reactions

Reactions