| Properties | Image |
|---|
| MNX_ID | MNXM224741 |
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| reference | slm:000472306 |
| formula | C52H99O13P2 |
| global charge | -3 |
| mol weight | 994.299 |
| InChIKey | RCTYEZADUDFTHI-DGFAMXQASA-K |
| InChI | InChI=1S/C52H102O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-52(55)65-50(48-64-67(59,60)63-46-49(53)45-62-66(56,57)58)47-61-51(54)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h18,20,49-50,53H,3-17,19,21-48H2,1-2H3,(H,59,60)(H2,56,57,58)/p-3/b20-18-/t49-,50+/m0/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H102O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-52(55)65-50(48-64-67(59,60)63-46-49(53)45-62-66(56,57)58)47-61-51(54)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h18,20,49-50,53H,3-17,19,21-48H2,1-2H3,(H,59,60)(H2,56,57,58)/b20-18-/t49-,50+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:52](=[O:55])[O:65][C@H:50]([CH2:47][O:61][C:51]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:22]/[CH:20]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54])[CH2:48][O:64][P:67]([OH:59])(=[O:60])[O:63][CH2:46][C@H:49]([CH2:45][O:62][P:66]([OH:56])([OH:57])=[O:58])[OH:53] |
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