4-oxo-2E-octadecenoic acid

Properties Image MNX_ID MNXM1130446 reference lipidmapsM:LMFA02000370 formula C18H32O3 global charge 0 mol weight 296.451 InChIKey DOCHQQOWHPNKAZ-FOCLMDBBSA-N InChI InChI=1S/C18H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h15-16H,2-14H2,1H3,(H,20,21)/b16-15+ SMILES CCCCCCCCCCCCCCC(=O)/C=C/C(=O)O MNX internals InChI (mnx) InChI=1/C18H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h15-16H,2-14H2,1H3,(H,20,21)/b16-15+ SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:17](/[CH:15]=[CH:16]/[C:18](=[O:20])[OH:21])=[O:19]

Parent-child relations graph

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