| Properties | Image |
|---|
| MNX_ID | MNXM185087 |
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| reference | slm:000036803 |
| formula | C47H86O10P |
| global charge | -1 |
| mol weight | 842.169 |
| InChIKey | QTYWQOFHVVYYOJ-OMTBQZBHSA-M |
| InChI | InChI=1S/C47H87O10P/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-26-28-30-32-34-36-38-46(50)54-42-45(43-56-58(52,53)55-41-44(49)40-48)57-47(51)39-37-35-33-31-29-27-24-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,44-45,48-49H,3-10,12,14-16,18,20-21,24-43H2,1-2H3,(H,52,53)/p-1/b13-11-,19-17-,23-22-/t44-,45+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C47H87O10P/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-26-28-30-32-34-36-38-46(50)54-42-45(43-56-58(52,53)55-41-44(49)40-48)57-47(51)39-37-35-33-31-29-27-24-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,44-45,48-49H,3-10,12,14-16,18,20-21,24-43H2,1-2H3,(H,52,53)/b13-11-,19-17-,23-22-/t44-,45+/m0/s1 |
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| 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:22]=[CH:23]\[CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][C:46](=[O:50])[O:54][CH2:42][C@H:45]([CH2:43][O:56][P:58]([OH:52])(=[O:53])[O:55][CH2:41][C@H:44]([CH2:40][OH:48])[OH:49])[O:57][C:47]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:24][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51] |
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