1-butanoyl-2-tridecanoyl-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM344510 reference slm:000035078 formula C22H44NO8P global charge 0 mol weight 481.567 InChIKey JWSBHLAGZCUFEZ-HXUWFJFHSA-N InChI InChI=1S/C22H44NO8P/c1-3-5-6-7-8-9-10-11-12-13-15-22(25)31-20(18-28-21(24)14-4-2)19-30-32(26,27)29-17-16-23/h20H,3-19,23H2,1-2H3,(H,26,27)/t20-/m1/s1 SMILES CCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C22H44NO8P/c1-3-5-6-7-8-9-10-11-12-13-15-22(25)31-20(18-28-21(24)14-4-2)19-30-32(26,27)29-17-16-23/h20H,3-19,23H2,1-2H3,(H,26,27)/t20-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:15][C:22](=[O:25])[O:31][C@H:20]([CH2:18][O:28][C:21]([CH2:14][CH2:4][CH3:2])=[O:24])[CH2:19][O:30][P:32]([OH:26])(=[O:27])[O:29][CH2:17][CH2:16][NH2:23]

Parent-child relations graph

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