| Properties | Image |
|---|
| MNX_ID | MNXM185866 |
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| reference | slm:000008082 |
| formula | C47H86NO8P |
| global charge | 0 |
| mol weight | 824.178 |
| InChIKey | DGLWHRIRJOOMNR-QFPLKGEMSA-N |
| InChI | InChI=1S/C47H86NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-33-36-39-47(50)56-45(43-55-57(51,52)54-41-40-48(4,5)6)42-53-46(49)38-35-32-30-27-28-31-34-37-44(2)3/h11-12,14-15,17-18,20-21,44-45H,7-10,13,16,19,22-43H2,1-6H3/b12-11-,15-14-,18-17-,21-20-/t45-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC(C)C)COP(=O)([O-])OCC[N+](C)(C)C |
MNX internals
| InChI (mnx) | InChI=1/C47H86NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-33-36-39-47(50)56-45(43-55-57(51,52)54-41-40-48(4,5)6)42-53-46(49)38-35-32-30-27-28-31-34-37-44(2)3/h11-12,14-15,17-18,20-21,44-45H,7-10,13,16,19,22-43H2,1-6H3/b12-11-,15-14-,18-17-,21-20-/t45-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:7][CH2:8][CH2:9][CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:29][CH2:33][CH2:36][CH2:39][C:47](=[O:50])[O:56][C@H:45]([CH2:42][O:53][C:46]([CH2:38][CH2:35][CH2:32][CH2:30][CH2:27][CH2:28][CH2:31][CH2:34][CH2:37][CH:44]([CH3:2])[CH3:3])=[O:49])[CH2:43][O:55][P:57](=[O:51])([O-:52])[O:54][CH2:41][CH2:40][N+:48]([CH3:4])([CH3:5])[CH3:6] |
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