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

Properties Image MNX_ID MNXM344315 reference slm:000035064 formula C30H60NO8P global charge 0 mol weight 593.783 InChIKey WZHXYVHMVAYFBU-MUUNZHRXSA-N InChI InChI=1S/C30H60NO8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-30(33)39-28(26-36-29(32)22-4-2)27-38-40(34,35)37-25-24-31/h28H,3-27,31H2,1-2H3,(H,34,35)/t28-/m1/s1 SMILES CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C30H60NO8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-30(33)39-28(26-36-29(32)22-4-2)27-38-40(34,35)37-25-24-31/h28H,3-27,31H2,1-2H3,(H,34,35)/t28-/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][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:23][C:30](=[O:33])[O:39][C@H:28]([CH2:26][O:36][C:29]([CH2:22][CH2:4][CH3:2])=[O:32])[CH2:27][O:38][P:40]([OH:34])(=[O:35])[O:37][CH2:25][CH2:24][NH2:31]

Parent-child relations graph

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