| Properties | Image |
|---|
| MNX_ID | MNXM236197 |
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| reference | slm:000038378 |
| formula | C51H98O10P |
| global charge | -1 |
| mol weight | 902.309 |
| InChIKey | TWOFZMIOJSCWCL-UEXFKKGZSA-M |
| InChI | InChI=1S/C51H99O10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-27-28-30-32-34-36-38-40-42-50(54)58-46-49(47-60-62(56,57)59-45-48(53)44-52)61-51(55)43-41-39-37-35-33-31-29-26-22-20-18-16-14-12-10-8-6-4-2/h17,19,48-49,52-53H,3-16,18,20-47H2,1-2H3,(H,56,57)/p-1/b19-17-/t48-,49+/m0/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H99O10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-27-28-30-32-34-36-38-40-42-50(54)58-46-49(47-60-62(56,57)59-45-48(53)44-52)61-51(55)43-41-39-37-35-33-31-29-26-22-20-18-16-14-12-10-8-6-4-2/h17,19,48-49,52-53H,3-16,18,20-47H2,1-2H3,(H,56,57)/b19-17-/t48-,49+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:24][CH2:25][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][C:50](=[O:54])[O:58][CH2:46][C@H:49]([CH2:47][O:60][P:62]([OH:56])(=[O:57])[O:59][CH2:45][C@H:48]([CH2:44][OH:52])[OH:53])[O:61][C:51]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:26][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:55] |
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