1-acetyl-2-octanoyl-sn-glycero-3-phosphocholine

Properties Image MNX_ID MNXM343180 reference slm:000012569 formula C18H36NO8P global charge 0 mol weight 425.459 InChIKey ZNFLFEVMGGIKAY-QGZVFWFLSA-N InChI InChI=1S/C18H36NO8P/c1-6-7-8-9-10-11-18(21)27-17(14-24-16(2)20)15-26-28(22,23)25-13-12-19(3,4)5/h17H,6-15H2,1-5H3/t17-/m1/s1 SMILES CCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OCC[N+](C)(C)C MNX internals InChI (mnx) InChI=1/C18H36NO8P/c1-6-7-8-9-10-11-18(21)27-17(14-24-16(2)20)15-26-28(22,23)25-13-12-19(3,4)5/h17H,6-15H2,1-5H3/t17-/m1/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C:18](=[O:21])[O:27][C@H:17]([CH2:14][O:24][C:16]([CH3:2])=[O:20])[CH2:15][O:26][P:28](=[O:22])([O-:23])[O:25][CH2:13][CH2:12][N+:19]([CH3:3])([CH3:4])[CH3:5]

Parent-child relations graph

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