| Properties | Image |
MNX_ID | MNXM69641 |
 |
reference | chebi:143716 |
formula | C44H84NO8P |
global charge | 0 |
mol weight | 786.129 |
InChIKey | AFJHDZQJNQZCSX-OOPGIKNFSA-N |
InChI | InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h28-31,42H,6-27,32-41H2,1-5H3/b30-28-,31-29-/t42-/m1/s1 |
SMILES | CCCCCCCCCCCC/C=C\CCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\CCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h28-31,42H,6-27,32-41H2,1-5H3/b30-28-,31-29-/t42-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26]/[CH:28]=[CH:30]\[CH2:32][CH2:34][CH2:36][C:43](=[O:46])[O:50][CH2:40][C@H:42]([CH2:41][O:52][P:54](=[O:48])([O-:49])[O:51][CH2:39][CH2:38][N+:45]([CH3:3])([CH3:4])[CH3:5])[O:53][C:44]([CH2:37][CH2:35][CH2:33]/[CH:31]=[CH:29]\[CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:47] |
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