| Properties | Image |
|---|
| MNX_ID | MNXM222028 |
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| reference | slm:000472244 |
| formula | C43H81O13P2 |
| global charge | -3 |
| mol weight | 868.056 |
| InChIKey | DEHWCJXHWHQVHS-UWSJFRPISA-K |
| InChI | InChI=1S/C43H84O13P2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-42(45)52-37-41(38-55-58(50,51)54-36-40(44)35-53-57(47,48)49)56-43(46)34-31-28-25-22-19-20-23-26-29-32-39(2)3/h11-12,39-41,44H,4-10,13-38H2,1-3H3,(H,50,51)(H2,47,48,49)/p-3/b12-11-/t40-,41+/m0/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C43H84O13P2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-42(45)52-37-41(38-55-58(50,51)54-36-40(44)35-53-57(47,48)49)56-43(46)34-31-28-25-22-19-20-23-26-29-32-39(2)3/h11-12,39-41,44H,4-10,13-38H2,1-3H3,(H,50,51)(H2,47,48,49)/b12-11-/t40-,41+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]/[CH:11]=[CH:12]\[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][C:42](=[O:45])[O:52][CH2:37][C@H:41]([CH2:38][O:55][P:58]([OH:50])(=[O:51])[O:54][CH2:36][C@H:40]([CH2:35][O:53][P:57]([OH:47])([OH:48])=[O:49])[OH:44])[O:56][C:43]([CH2:34][CH2:31][CH2:28][CH2:25][CH2:22][CH2:19][CH2:20][CH2:23][CH2:26][CH2:29][CH2:32][CH:39]([CH3:2])[CH3:3])=[O:46] |
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