| Properties | Image |
|---|
| MNX_ID | MNXM183195 |
 |
| reference | slm:000014413 |
| formula | C51H82O13P |
| global charge | -1 |
| mol weight | 934.178 |
| InChIKey | JDNSPIRGIXFCBN-MLXXLCSSSA-M |
| InChI | InChI=1S/C51H83O13P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-44(52)61-41-43(42-62-65(59,60)64-51-49(57)47(55)46(54)48(56)50(51)58)63-45(53)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22,24,26,28,32,34,43,46-51,54-58H,3-5,7,9-10,15-16,21,23,25,27,29-31,33,35-42H2,1-2H3,(H,59,60)/p-1/b8-6-,13-11-,14-12-,19-17-,20-18-,24-22-,28-26-,34-32-/t43-,46-,47-,48+,49-,50-,51-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C51H83O13P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-44(52)61-41-43(42-62-65(59,60)64-51-49(57)47(55)46(54)48(56)50(51)58)63-45(53)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22,24,26,28,32,34,43,46-51,54-58H,3-5,7,9-10,15-16,21,23,25,27,29-31,33,35-42H2,1-2H3,(H,59,60)/b8-6-,13-11-,14-12-,19-17-,20-18-,24-22-,28-26-,34-32-/t43-,46-,47-,48+,49-,50-,51-/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:22]=[CH:24]\[CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][C:44](=[O:52])[O:61][CH2:41][C@H:43]([CH2:42][O:62][P:65]([OH:59])(=[O:60])[O:64][C@@H:51]1[C@H:49]([OH:57])[C@H:47]([OH:55])[C@@H:46]([OH:54])[C@H:48]([OH:56])[C@H:50]1[OH:58])[O:63][C:45]([CH2:40][CH2:38][CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:53] |
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