(5E)-tetradecenoyl-(R)-carnitine

Properties Image MNX_ID MNXM163039 reference chebi:131957 formula C21H39NO4 global charge 0 mol weight 369.546 InChIKey NNCBVXBBLABOCB-JXOMPUQVSA-N InChI InChI=1S/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12+/t19-/m1/s1 SMILES CCCCCCCC/C=C/CCCC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C MNX internals InChI (mnx) InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12+/t19-/m1/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]/[CH:12]=[CH:13]/[CH2:14][CH2:15][CH2:16][C:21](=[O:25])[O:26][C@H:19]([CH2:17][C:20](=[O:23])[O-:24])[CH2:18][N+:22]([CH3:2])([CH3:3])[CH3:4]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0