| Properties | Image |
|---|
| MNX_ID | MNXM180632 |
 |
| reference | slm:000036649 |
| formula | C49H84O10P |
| global charge | -1 |
| mol weight | 864.175 |
| InChIKey | LNSUONFBRGCFHB-WURGGGCTSA-M |
| InChI | InChI=1S/C49H85O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-31-32-34-36-38-40-48(52)56-44-47(45-58-60(54,55)57-43-46(51)42-50)59-49(53)41-39-37-35-33-30-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,26-27,46-47,50-51H,3-4,6,8-10,12,14-16,19,22,25,28-45H2,1-2H3,(H,54,55)/p-1/b7-5-,13-11-,18-17-,21-20-,24-23-,27-26-/t46-,47+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C49H85O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-31-32-34-36-38-40-48(52)56-44-47(45-58-60(54,55)57-43-46(51)42-50)59-49(53)41-39-37-35-33-30-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,26-27,46-47,50-51H,3-4,6,8-10,12,14-16,19,22,25,28-45H2,1-2H3,(H,54,55)/b7-5-,13-11-,18-17-,21-20-,24-23-,27-26-/t46-,47+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:48](=[O:52])[O:56][CH2:44][C@H:47]([CH2:45][O:58][P:60]([OH:54])(=[O:55])[O:57][CH2:43][C@H:46]([CH2:42][OH:50])[OH:51])[O:59][C:49]([CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:30][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:53] |
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