HMDB0289705 RDKit 3D PC(P-18:1(11Z)/20:4(6E,8Z,11Z,13E)-2OH(5S,15S)) 139138 0 0 0 0 0 0 0 0999 V2000 -8.4870 0.5485 2.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2394 2.0199 2.3372 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9387 2.3299 1.7036 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7015 1.9351 0.2981 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7658 0.4950 -0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4516 0.2805 -1.5412 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1153 0.7675 -1.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1829 -0.0361 -2.3412 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3502 -1.4868 -2.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3215 -2.1514 -1.6689 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3271 -3.6302 -1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3032 -4.2015 -0.8213 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 -3.7443 -1.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1068 -4.3427 -0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1369 -3.9933 1.2445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1033 -2.5178 1.5387 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1977 -1.9018 1.2092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9151 -1.3048 2.1756 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1255 -0.7263 1.8983 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9908 -0.0907 2.7127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6074 1.1486 3.4414 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5611 1.0526 4.4728 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7228 0.0945 5.4483 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4576 0.0934 6.5663 P 0 0 0 0 0 5 0 0 0 0 0 0 1.0802 1.5237 6.9214 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8329 -0.7757 7.9614 O 0 0 0 0 0 1 0 0 0 0 0 0 0.1587 -0.7061 5.8141 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.0898 5.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0517 -0.6723 5.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -1.8678 5.6637 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.1077 -2.6967 4.6209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5292 -1.6545 6.6475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -2.6587 6.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 2.2044 2.5435 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0263 3.2768 2.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 3.2146 2.8423 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 4.4255 1.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4903 4.5645 0.6731 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0369 3.7370 -0.4401 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8876 2.2797 -0.3856 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0103 1.5258 -0.1946 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 1.7340 -1.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0151 2.3030 -2.7133 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2367 1.7988 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1864 2.3740 -4.9964 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9202 3.5771 -5.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9483 3.6045 -6.3225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3996 2.6210 -7.0321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9966 1.2518 -7.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5687 0.3694 -7.8237 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1147 -1.0350 -7.7636 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7410 -1.0538 -8.1549 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.6350 -6.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4719 -1.7084 -5.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2271 -2.3818 -4.3768 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4686 -2.5377 -3.5624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -3.2313 -2.2484 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8372 0.3580 3.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5947 -0.0870 2.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3132 0.2488 1.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2841 2.5212 3.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0693 2.4884 1.7424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1412 1.7999 2.3304 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7538 3.4379 1.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7489 2.4162 -0.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4906 2.4745 -0.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0426 -0.0959 0.5513 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7969 0.0827 0.0662 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1740 1.0171 -2.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7121 -0.7322 -1.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 1.8462 -1.7631 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1882 0.4187 -2.5812 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3203 -1.9129 -2.4018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0836 -1.7371 -3.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3423 -1.7051 -1.9985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5743 -1.8593 -0.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1273 -3.9943 -2.8123 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3373 -4.0127 -1.5078 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3489 -5.3182 -0.9476 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6257 -3.9546 0.2157 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -2.6445 -1.1926 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6554 -4.1320 -2.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0285 -5.4513 -0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -4.0638 -0.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0899 -4.4498 1.5661 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6614 -4.4775 1.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8599 -1.9744 0.9205 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3945 -2.3901 2.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5658 -1.9327 0.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4546 -1.3313 3.1523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4706 -0.8440 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8936 0.2131 2.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6016 1.5235 3.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 0.8813 3.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4229 2.0656 4.9732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7538 1.0725 5.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2636 0.3721 6.7535 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7217 -0.9678 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9653 -0.0506 4.8515 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -1.9729 4.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2873 -3.1320 4.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7864 -3.4333 5.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2103 -1.0745 7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4061 -1.2739 6.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -2.6808 7.0258 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7735 -3.6837 6.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9799 -2.2374 7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6362 -2.8569 5.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6215 4.5194 0.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9127 5.3379 2.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6023 4.6276 1.4214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 5.6643 0.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8275 3.9169 -1.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1199 4.2056 -0.9551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2435 2.0717 0.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6305 1.6060 -0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4936 0.8386 -1.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6128 3.1870 -2.8192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3796 0.8804 -3.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5016 1.9321 -5.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 4.1489 -4.3876 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1175 4.3402 -5.7084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4047 4.6208 -6.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2069 2.8913 -7.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2651 0.8682 -6.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3228 0.7034 -8.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6221 -1.6665 -8.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3796 -1.9695 -8.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7313 -2.6778 -6.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -1.1264 -5.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1429 -2.4113 -6.2754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -0.7549 -5.6382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9023 -3.4260 -4.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4085 -1.9203 -3.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2679 -3.0923 -4.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8826 -1.5453 -3.2499 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0426 -2.9088 -1.9989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9922 -4.3126 -2.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7721 -3.0272 -1.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 21 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 9 73 1 0 9 74 1 0 10 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 13 82 1 0 14 83 1 0 14 84 1 0 15 85 1 0 15 86 1 0 16 87 1 0 16 88 1 0 17 89 1 0 18 90 1 0 20 91 1 0 20 92 1 0 21 93 1 1 22 94 1 0 22 95 1 0 28 96 1 0 28 97 1 0 29 98 1 0 29 99 1 0 31100 1 0 31101 1 0 31102 1 0 32103 1 0 32104 1 0 32105 1 0 33106 1 0 33107 1 0 33108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 1 41116 1 0 42117 1 0 43118 1 0 44119 1 0 45120 1 0 46121 1 0 46122 1 0 47123 1 0 48124 1 0 49125 1 0 50126 1 0 51127 1 6 52128 1 0 53129 1 0 53130 1 0 54131 1 0 54132 1 0 55133 1 0 55134 1 0 56135 1 0 56136 1 0 57137 1 0 57138 1 0 57139 1 0 M CHG 2 26 -1 30 1 M END