1-O-octadecyl-2-tridecanoyl-sn-glycero-3-phosphocholine

Properties Image MNX_ID MNXM70855 reference slm:000028341 formula C39H80NO7P global charge 0 mol weight 706.043 InChIKey VHLHDGWYOSJUCV-KXQOOQHDSA-N InChI InChI=1S/C39H80NO7P/c1-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-34-44-36-38(37-46-48(42,43)45-35-33-40(3,4)5)47-39(41)32-30-28-26-24-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1 SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C39H80NO7P/c1-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-34-44-36-38(37-46-48(42,43)45-35-33-40(3,4)5)47-39(41)32-30-28-26-24-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:34][O:44][CH2:36][C@H:38]([CH2:37][O:46][P:48](=[O:42])([O-:43])[O:45][CH2:35][CH2:33][N+:40]([CH3:3])([CH3:4])[CH3:5])[O:47][C:39]([CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:41]

Parent-child relations graph

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