1-butanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM344190 reference slm:000035055 formula C27H50NO8P global charge 0 mol weight 547.67 InChIKey XZDVNKSGSJHRNQ-DFHXAIIHSA-N InChI InChI=1S/C27H50NO8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-27(30)36-25(23-33-26(29)19-4-2)24-35-37(31,32)34-22-21-28/h8-9,11-12,25H,3-7,10,13-24,28H2,1-2H3,(H,31,32)/b9-8-,12-11-/t25-/m1/s1 SMILES CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C27H50NO8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-27(30)36-25(23-33-26(29)19-4-2)24-35-37(31,32)34-22-21-28/h8-9,11-12,25H,3-7,10,13-24,28H2,1-2H3,(H,31,32)/b9-8-,12-11-/t25-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:20][C:27](=[O:30])[O:36][C@H:25]([CH2:23][O:33][C:26]([CH2:19][CH2:4][CH3:2])=[O:29])[CH2:24][O:35][P:37]([OH:31])(=[O:32])[O:34][CH2:22][CH2:21][NH2:28]

Parent-child relations graph

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