12-Nitro-9Z,12Z-octadecadienoic acid

Properties Image MNX_ID MNXM33273 reference chebi:34150 formula C18H31NO4 global charge 0 mol weight 325.449 InChIKey ZYFTUIURWQWFKQ-QIAGQCQHSA-N InChI InChI=1S/C18H31NO4/c1-2-3-4-11-14-17(19(22)23)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,14H,2-8,10-11,13,15-16H2,1H3,(H,20,21)/b12-9-,17-14+ SMILES CCCCC/C=C(\C/C=C\CCCCCCCC(=O)O)[N+](=O)[O-] MNX internals InChI (mnx) InChI=1/C18H31NO4/c1-2-3-4-11-14-17(19(22)23)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,14H,2-8,10-11,13,15-16H2,1H3,(H,20,21)/b12-9-,17-14+ SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:11]/[CH:14]=[C:17](\[CH2:15]/[CH:12]=[CH:9]\[CH2:7][CH2:5][CH2:6][CH2:8][CH2:10][CH2:13][CH2:16][C:18](=[O:20])[OH:21])[N+:19]([O-:22])=[O:23]

Parent-child relations graph

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