| Properties | Image |
|---|
| MNX_ID | MNXM318345 |
 |
| reference | slm:000004983 |
| formula | C44H77NO10P |
| global charge | -1 |
| mol weight | 811.071 |
| InChIKey | JZPLUZCMIFIOFD-GXTRJHBGSA-M |
| InChI | InChI=1S/C44H78NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-25-14-12-10-8-6-4-2/h11,13,16-17,19-20,22-23,40-41H,3-10,12,14-15,18,21,24-39,45H2,1-2H3,(H,48,49)(H,50,51)/p-1/b13-11-,17-16-,20-19-,23-22-/t40-,41+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-25-14-12-10-8-6-4-2/h11,13,16-17,19-20,22-23,40-41H,3-10,12,14-15,18,21,24-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,17-16-,20-19-,23-22-/t40-,41+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][C:42](=[O:46])[O:52][CH2:37][C@H:40]([CH2:38][O:53][P:56]([OH:50])(=[O:51])[O:54][CH2:39][C@@H:41]([C:44](=[O:48])[OH:49])[NH2:45])[O:55][C:43]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:25][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:47] |
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