| Properties | Image |
|---|
| MNX_ID | MNXM70680 |
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| reference | hmdb:HMDB0008785 |
| formula | C50H100NO7P |
| global charge | 0 |
| mol weight | 858.324 |
| InChIKey | RGQRAIBRPXHXFR-BHYVKQBPSA-N |
| InChI | InChI=1S/C50H100NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-31-33-35-37-39-41-43-50(52)56-47-49(48-58-59(53,54)57-46-44-51(3,4)5)55-45-42-40-38-36-34-32-30-23-21-19-17-15-13-11-9-7-2/h42,45,49H,6-41,43-44,46-48H2,1-5H3/b45-42- |
| SMILES | CCCCCCCCCCCCCCCC/C=C\OC(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
MNX internals
| InChI (mnx) | InChI=1/C50H100NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-31-33-35-37-39-41-43-50(52)56-47-49(48-58-59(53,54)57-46-44-51(3,4)5)55-45-42-40-38-36-34-32-30-23-21-19-17-15-13-11-9-7-2/h42,45,49H,6-41,43-44,46-48H2,1-5H3/b45-42-/t49? |
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| SMILES (mnx) | [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:50](=[O:52])[O:56][CH2:47][CH:49]([CH2:48][O:58][P:59](=[O:53])([O-:54])[O:57][CH2:46][CH2:44][N+:51]([CH3:3])([CH3:4])[CH3:5])[O:55]/[CH:45]=[CH:42]\[CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2] |
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