PE(13:0/17:2(9Z,12Z))

Properties Image MNX_ID MNXM71218 reference lipidmapsM:LMGP02010388 formula C35H66NO8P global charge 0 mol weight 659.886 InChIKey JWRHKXZBXQJLGO-GLOYYYSISA-N InChI InChI=1S/C35H66NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-35(38)44-33(32-43-45(39,40)42-30-29-36)31-41-34(37)27-25-23-21-19-14-12-10-8-6-4-2/h9,11,15-16,33H,3-8,10,12-14,17-32,36H2,1-2H3,(H,39,40)/b11-9-,16-15-/t33-/m1/s1 SMILES CCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)OCCN MNX internals InChI (mnx) InChI=1/C35H66NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-35(38)44-33(32-43-45(39,40)42-30-29-36)31-41-34(37)27-25-23-21-19-14-12-10-8-6-4-2/h9,11,15-16,33H,3-8,10,12-14,17-32,36H2,1-2H3,(H,39,40)/b11-9-,16-15-/t33-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7]/[CH:9]=[CH:11]\[CH2:13]/[CH:15]=[CH:16]\[CH2:17][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][C:35](=[O:38])[O:44][C@H:33]([CH2:31][O:41][C:34]([CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37])[CH2:32][O:43][P:45]([OH:39])(=[O:40])[O:42][CH2:30][CH2:29][NH2:36]

Parent-child relations graph

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