| Properties | Image |
|---|
| MNX_ID | MNXM345158 |
 |
| reference | slm:000496710 |
| formula | C49H85O8P |
| global charge | -2 |
| mol weight | 833.185 |
| InChIKey | IGBWQSMENYMDNQ-AGZCFWNYSA-L |
| InChI | InChI=1S/C49H87O8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-49(51)57-47(46-56-58(52,53)54)45-55-48(50)43-41-39-37-10-8-6-4-2/h11-12,14-15,17-18,20-21,23-24,47H,3-10,13,16,19,22,25-46H2,1-2H3,(H2,52,53,54)/p-2/b12-11-,15-14-,18-17-,21-20-,24-23-/t47-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C49H87O8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-49(51)57-47(46-56-58(52,53)54)45-55-48(50)43-41-39-37-10-8-6-4-2/h11-12,14-15,17-18,20-21,23-24,47H,3-10,13,16,19,22,25-46H2,1-2H3,(H2,52,53,54)/b12-11-,15-14-,18-17-,21-20-,24-23-/t47-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:49](=[O:51])[O:57][C@H:47]([CH2:45][O:55][C:48]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:50])[CH2:46][O:56][P:58]([OH:52])([OH:53])=[O:54] |
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