| Properties | Image |
|---|
| MNX_ID | MNXM193443 |
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| reference | slm:000036989 |
| formula | C49H86O10P |
| global charge | -1 |
| mol weight | 866.191 |
| InChIKey | DWEQWMFJGNOJQT-MOOYXFSBSA-M |
| InChI | InChI=1S/C49H87O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-30-33-36-39-48(52)56-43-47(44-58-60(54,55)57-42-46(51)41-50)59-49(53)40-37-34-31-28-25-22-23-26-29-32-35-38-45(2)3/h5-6,8-9,11-12,14-15,17-18,45-47,50-51H,4,7,10,13,16,19-44H2,1-3H3,(H,54,55)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-/t46-,47+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C49H87O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-30-33-36-39-48(52)56-43-47(44-58-60(54,55)57-42-46(51)41-50)59-49(53)40-37-34-31-28-25-22-23-26-29-32-35-38-45(2)3/h5-6,8-9,11-12,14-15,17-18,45-47,50-51H,4,7,10,13,16,19-44H2,1-3H3,(H,54,55)/b6-5-,9-8-,12-11-,15-14-,18-17-/t46-,47+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][CH2:36][CH2:39][C:48](=[O:52])[O:56][CH2:43][C@H:47]([CH2:44][O:58][P:60]([OH:54])(=[O:55])[O:57][CH2:42][C@H:46]([CH2:41][OH:50])[OH:51])[O:59][C:49]([CH2:40][CH2:37][CH2:34][CH2:31][CH2:28][CH2:25][CH2:22][CH2:23][CH2:26][CH2:29][CH2:32][CH2:35][CH2:38][CH:45]([CH3:2])[CH3:3])=[O:53] |
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