PE(15:1(9Z)/18:3(6Z,9Z,12Z))

Properties Image MNX_ID MNXM71383 reference lipidmapsM:LMGP02010488 formula C38H68NO8P global charge 0 mol weight 697.935 InChIKey BCQGVQKSJQEVMA-FQSPJEOGSA-N InChI InChI=1S/C38H68NO8P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-38(41)47-36(35-46-48(42,43)45-33-32-39)34-44-37(40)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h11-14,17-18,21,23,36H,3-10,15-16,19-20,22,24-35,39H2,1-2H3,(H,42,43)/b13-11-,14-12-,18-17-,23-21-/t36-/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCC)COP(=O)(O)OCCN MNX internals InChI (mnx) InChI=1/C38H68NO8P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-38(41)47-36(35-46-48(42,43)45-33-32-39)34-44-37(40)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h11-14,17-18,21,23,36H,3-10,15-16,19-20,22,24-35,39H2,1-2H3,(H,42,43)/b13-11-,14-12-,18-17-,23-21-/t36-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25][CH2:27][CH2:29][CH2:31][C:38](=[O:41])[O:47][C@H:36]([CH2:34][O:44][C:37]([CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:40])[CH2:35][O:46][P:48]([OH:42])(=[O:43])[O:45][CH2:33][CH2:32][NH2:39]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0