| Properties | Image |
MNX_ID | MNXM71433 |
 |
reference | lipidmapsM:LMGP02010512 |
formula | C43H84NO8P |
global charge | 0 |
mol weight | 774.118 |
InChIKey | INYNPLWPMOAPKE-DWNNZWKSSA-N |
InChI | InChI=1S/C43H84NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h19-20,41H,3-18,21-40,44H2,1-2H3,(H,47,48)/b20-19-/t41-/m1/s1 |
SMILES | CCCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCN |
MNX internals
InChI (mnx) | InChI=1/C43H84NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h19-20,41H,3-18,21-40,44H2,1-2H3,(H,47,48)/b20-19-/t41-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][C:43](=[O:46])[O:52][C@H:41]([CH2:39][O:49][C:42]([CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:45])[CH2:40][O:51][P:53]([OH:47])(=[O:48])[O:50][CH2:38][CH2:37][NH2:44] |
|