| Properties | Image |
MNX_ID | MNXM218333 |
 |
reference | slm:000022047 |
formula | C51H87O8P |
global charge | -2 |
mol weight | 859.223 |
InChIKey | GHJCSTHQDURXJC-MOYMHKPVSA-L |
InChI | InChI=1S/C51H89O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-28-30-32-34-36-38-40-42-44-46-51(53)59-49(48-58-60(54,55)56)47-57-50(52)45-43-41-39-37-35-33-31-29-27-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26,28,49H,3-10,15-16,21-22,25,27,29-48H2,1-2H3,(H2,54,55,56)/p-2/b13-11-,14-12-,19-17-,20-18-,24-23-,28-26-/t49-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C51H89O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-28-30-32-34-36-38-40-42-44-46-51(53)59-49(48-58-60(54,55)56)47-57-50(52)45-43-41-39-37-35-33-31-29-27-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26,28,49H,3-10,15-16,21-22,25,27,29-48H2,1-2H3,(H2,54,55,56)/b13-11-,14-12-,19-17-,20-18-,24-23-,28-26-/t49-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:28]\[CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:51](=[O:53])[O:59][C@H:49]([CH2:47][O:57][C:50]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:52])[CH2:48][O:58][P:60]([OH:54])([OH:55])=[O:56] |
|