| Properties | Image |
|---|
| MNX_ID | MNXM1130987 |
 |
| reference | lipidmapsM:LMPK03000051 |
| formula | C37H68O6 |
| global charge | 0 |
| mol weight | 608.945 |
| InChIKey | FFYADDYFFJTVSC-URCADZRVSA-N |
| InChI | InChI=1S/C37H68O6/c1-3-4-5-6-7-8-9-10-15-20-25-33(39)35-27-28-36(43-35)34(40)26-21-16-19-24-32(38)23-18-14-12-11-13-17-22-31-29-30(2)42-37(31)41/h29-30,32-36,38-40H,3-28H2,1-2H3/t30-,32?,33+,34+,35+,36+/m0/s1 |
| SMILES | CCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCC(O)CCCCCCCCC2=C[C@H](C)OC2=O)O1 |
MNX internals
| InChI (mnx) | InChI=1/C37H68O6/c1-3-4-5-6-7-8-9-10-15-20-25-33(39)35-27-28-36(43-35)34(40)26-21-16-19-24-32(38)23-18-14-12-11-13-17-22-31-29-30(2)42-37(31)41/h29-30,32-36,38-40H,3-28H2,1-2H3/t30-,32?,33+,34+,35+,36+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:15][CH2:20][CH2:25][C@H:33]([C@H:35]1[CH2:27][CH2:28][C@H:36]([C@@H:34]([CH2:26][CH2:21][CH2:16][CH2:19][CH2:24][CH:32]([CH2:23][CH2:18][CH2:14][CH2:12][CH2:11][CH2:13][CH2:17][CH2:22][C:31]2=[CH:29][C@H:30]([CH3:2])[O:42][C:37]2=[O:41])[OH:38])[OH:40])[O:43]1)[OH:39] |
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