1-(9Z-tetradecenoyl)-2-octanoyl-sn-glycero-3-phosphocholine

Properties Image MNX_ID MNXM338249 reference slm:000012412 formula C30H58NO8P global charge 0 mol weight 591.767 InChIKey KKLCLXKXUSCQRE-FQGSIFQHSA-N InChI InChI=1S/C30H58NO8P/c1-6-8-10-12-13-14-15-16-17-19-20-22-29(32)36-26-28(39-30(33)23-21-18-11-9-7-2)27-38-40(34,35)37-25-24-31(3,4)5/h12-13,28H,6-11,14-27H2,1-5H3/b13-12-/t28-/m1/s1 SMILES CCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC MNX internals InChI (mnx) InChI=1/C30H58NO8P/c1-6-8-10-12-13-14-15-16-17-19-20-22-29(32)36-26-28(39-30(33)23-21-18-11-9-7-2)27-38-40(34,35)37-25-24-31(3,4)5/h12-13,28H,6-11,14-27H2,1-5H3/b13-12-/t28-/m1/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:8][CH2:10]/[CH:12]=[CH:13]\[CH2:14][CH2:15][CH2:16][CH2:17][CH2:19][CH2:20][CH2:22][C:29](=[O:32])[O:36][CH2:26][C@H:28]([CH2:27][O:38][P:40](=[O:34])([O-:35])[O:37][CH2:25][CH2:24][N+:31]([CH3:3])([CH3:4])[CH3:5])[O:39][C:30]([CH2:23][CH2:21][CH2:18][CH2:11][CH2:9][CH2:7][CH3:2])=[O:33]

Parent-child relations graph

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