CHEBI:34150 - 12-Nitro-9Z,12Z-octadecadienoic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 12-Nitro-9Z,12Z-octadecadienoic acid ChEBI ID CHEBI:34150 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H31NO4 Net Charge 0 Average Mass 325.444 Monoisotopic Mass 325.22531 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+ InChIKey ZYFTUIURWQWFKQ-QIAGQCQHSA-N SMILES CCCCC\C=C(/C\C=C/CCCCCCCC(O)=O)[N+]([O-])=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 12-Nitro-9Z,12Z-octadecadienoic acid (CHEBI:34150) is a nitro fatty acid (CHEBI:86286) 12-Nitro-9Z,12Z-octadecadienoic acid (CHEBI:34150) is a octadecadienoic acid (CHEBI:25627) Synonyms Sources (9Z,12E)-12-Nitrooctadeca-9,12-dienoic acid KEGG COMPOUND (9Z,12Z)-12-Nitrooctadeca-9,12-dienoic acid KEGG COMPOUND 12-Nitro-9-cis,12-cis-octadecadienoic acid KEGG COMPOUND 12-Nitro-9Z,12Z-octadecadienoate KEGG COMPOUND 12-Nitro-9Z,12Z-octadecadienoic acid KEGG COMPOUND Manual Xrefs Databases C13958 KEGG COMPOUND LNB PDBeChem View more database links Last Modified 23 February 2022