1-(11E-octadecenoyl)-2-hexanoyl-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM192575 reference slm:000030485 formula C29H56NO8P global charge 0 mol weight 577.74 InChIKey GWZBPKGKCLNMET-JZILDOMLSA-N InChI InChI=1S/C29H56NO8P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-21-28(31)35-25-27(38-29(32)22-19-6-4-2)26-37-39(33,34)36-24-23-30/h10-11,27H,3-9,12-26,30H2,1-2H3,(H,33,34)/b11-10+/t27-/m1/s1 SMILES CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCC MNX internals InChI (mnx) InChI=1/C29H56NO8P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-21-28(31)35-25-27(38-29(32)22-19-6-4-2)26-37-39(33,34)36-24-23-30/h10-11,27H,3-9,12-26,30H2,1-2H3,(H,33,34)/b11-10+/t27-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9]/[CH:10]=[CH:11]/[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:20][CH2:21][C:28](=[O:31])[O:35][CH2:25][C@H:27]([CH2:26][O:37][P:39]([OH:33])(=[O:34])[O:36][CH2:24][CH2:23][NH2:30])[O:38][C:29]([CH2:22][CH2:19][CH2:6][CH2:4][CH3:2])=[O:32]

Parent-child relations graph

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