| Properties | Image |
MNX_ID | MNXM70799 |
 |
reference | lipidmapsM:LMGP01020183 |
formula | C41H82NO7P |
global charge | 0 |
mol weight | 732.081 |
InChIKey | QTZVLTGOPOCYIL-VDLQPGGRSA-N |
InChI | InChI=1S/C41H82NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42(3,4)5)38-46-36-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h18,20,40H,6-17,19,21-39H2,1-5H3/b20-18-/t40-/m1/s1 |
SMILES | CCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
MNX internals
InChI (mnx) | InChI=1/C41H82NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42(3,4)5)38-46-36-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h18,20,40H,6-17,19,21-39H2,1-5H3/b20-18-/t40-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16]/[CH:18]=[CH:20]\[CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][C:41](=[O:43])[O:49][C@H:40]([CH2:38][O:46][CH2:36][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])[CH2:39][O:48][P:50](=[O:44])([O-:45])[O:47][CH2:37][CH2:35][N+:42]([CH3:3])([CH3:4])[CH3:5] |
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