| Properties | Image |
|---|
| MNX_ID | MNXM192301 |
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| reference | slm:000001566 |
| formula | C44H83NO10P |
| global charge | -1 |
| mol weight | 817.119 |
| InChIKey | OCCHNTXZVKCXFK-VLQXWXLJSA-M |
| InChI | InChI=1S/C44H84NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16,40-41H,3-13,15,17-39,45H2,1-2H3,(H,48,49)(H,50,51)/p-1/b16-14+/t40-,41+/m1/s1 |
| SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C44H84NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16,40-41H,3-13,15,17-39,45H2,1-2H3,(H,48,49)(H,50,51)/b16-14+/t40-,41+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][C:43](=[O:47])[O:55][C@H:40]([CH2:37][O:52][C:42]([CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:46])[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] |
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