1-(13-methyltetradecanoyl)-2-decanoyl-sn-glycero-3-phosphocholine

Properties Image MNX_ID MNXM214697 reference slm:000008848 formula C33H66NO8P global charge 0 mol weight 635.864 InChIKey DBESMQXHXCIOOI-WJOKGBTCSA-N InChI InChI=1S/C33H66NO8P/c1-7-8-9-10-14-19-22-25-33(36)42-31(29-41-43(37,38)40-27-26-34(4,5)6)28-39-32(35)24-21-18-16-13-11-12-15-17-20-23-30(2)3/h30-31H,7-29H2,1-6H3/t31-/m1/s1 SMILES CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)COP(=O)([O-])OCC[N+](C)(C)C MNX internals InChI (mnx) InChI=1/C33H66NO8P/c1-7-8-9-10-14-19-22-25-33(36)42-31(29-41-43(37,38)40-27-26-34(4,5)6)28-39-32(35)24-21-18-16-13-11-12-15-17-20-23-30(2)3/h30-31H,7-29H2,1-6H3/t31-/m1/s1 SMILES (mnx) [CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:14][CH2:19][CH2:22][CH2:25][C:33](=[O:36])[O:42][C@H:31]([CH2:28][O:39][C:32]([CH2:24][CH2:21][CH2:18][CH2:16][CH2:13][CH2:11][CH2:12][CH2:15][CH2:17][CH2:20][CH2:23][CH:30]([CH3:2])[CH3:3])=[O:35])[CH2:29][O:41][P:43](=[O:37])([O-:38])[O:40][CH2:27][CH2:26][N+:34]([CH3:4])([CH3:5])[CH3:6]

Parent-child relations graph

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