| Properties | Image |
|---|
| MNX_ID | MNXM185151 |
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| reference | slm:000021005 |
| formula | C53H97O8P |
| global charge | -2 |
| mol weight | 893.325 |
| InChIKey | KGEHMEPXMCRYMP-CHIULOQSSA-L |
| InChI | InChI=1S/C53H99O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-48-53(55)61-51(50-60-62(56,57)58)49-59-52(54)47-45-43-41-39-37-35-33-31-29-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,29,31,51H,3-11,13,15-17,19,21-28,30,32-50H2,1-2H3,(H2,56,57,58)/p-2/b14-12-,20-18-,31-29-/t51-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H99O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-48-53(55)61-51(50-60-62(56,57)58)49-59-52(54)47-45-43-41-39-37-35-33-31-29-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,29,31,51H,3-11,13,15-17,19,21-28,30,32-50H2,1-2H3,(H2,56,57,58)/b14-12-,20-18-,31-29-/t51-/m1/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][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:53](=[O:55])[O:61][C@H:51]([CH2:49][O:59][C:52]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33]/[CH:31]=[CH:29]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54])[CH2:50][O:60][P:62]([OH:56])([OH:57])=[O:58] |
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