| Properties | Image |
| MNX_ID | MNXM1131005 |
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| reference | lipidmapsM:LMPK03000069 |
| formula | C35H64O7 |
| global charge | 0 |
| mol weight | 596.89 |
| InChIKey | OGVXPARQSVANAX-BPCBDIFXSA-N |
| InChI | InChI=1S/C35H64O7/c1-3-4-5-8-13-18-29(36)19-14-9-6-11-16-21-31(38)33-23-24-34(42-33)32(39)22-17-12-7-10-15-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30-,31+,32+,33+,34+/m0/s1 |
| SMILES | CCCCCCCC(O)CCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCCC[C@H](O)CC2=C[C@H](C)OC2=O)O1 |
MNX internals
| InChI (mnx) | InChI=1/C35H64O7/c1-3-4-5-8-13-18-29(36)19-14-9-6-11-16-21-31(38)33-23-24-34(42-33)32(39)22-17-12-7-10-15-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30-,31+,32+,33+,34+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:8][CH2:13][CH2:18][CH:29]([CH2:19][CH2:14][CH2:9][CH2:6][CH2:11][CH2:16][CH2:21][C@H:31]([C@H:33]1[CH2:23][CH2:24][C@H:34]([C@@H:32]([CH2:22][CH2:17][CH2:12][CH2:7][CH2:10][CH2:15][CH2:20][C@@H:30]([CH2:26][C:28]2=[CH:25][C@H:27]([CH3:2])[O:41][C:35]2=[O:40])[OH:37])[OH:39])[O:42]1)[OH:38])[OH:36] |
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