CHEBI:34125 - 10-Nitro-9Z,12Z-octadecadienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 10-Nitro-9Z,12Z-octadecadienoic acid
ChEBI ID CHEBI:34125
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C18H31NO4
C18H31NO4
Net Charge 0
Average Mass 325.444
Monoisotopic Mass 325.22531
InChI InChI=1S/C18H31NO4/c1-2-3-4-5-8-11-14-17(19(22)23)15-12-9-6-7-10-13-16-18(20)21/h8,11,15H,2-7,9-10,12-14,16H2,1H3,(H,20,21)/b11-8-,17-15+
InChIKey LELVHAQTWXTCLY-XYWKCAQWSA-N
SMILES CCCCC\C=C/C\C(=C/CCCCCCCC(O)=O)[N+]([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
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 10-Nitro-9Z,12Z-octadecadienoic acid (CHEBI:34125) is a nitro fatty acid (CHEBI:86286)
10-Nitro-9Z,12Z-octadecadienoic acid (CHEBI:34125) is a octadecadienoic acid (CHEBI:25627)
Synonyms Sources
(9E,12Z)-10-nitrooctadeca-9,12-dienoic acid HMDB
(9E,12Z)-10-Nitrooctadeca-9,12-dienoic acid KEGG COMPOUND
(9Z,12Z)-10-Nitrooctadeca-9,12-dienoic acid KEGG COMPOUND
10-Nitro-9,12-octadecadienoate HMDB
10-Nitro-9,12-octadecadienoic acid HMDB
10-nitro-9-cis,12-cis-octadecadienoate KEGG COMPOUND
10-nitro-9-cis,12-cis-octadecadienoic acid KEGG COMPOUND
10-Nitro-9Z,12Z-octadecadienoate KEGG COMPOUND
10-Nitro-9Z,12Z-octadecadienoic acid KEGG COMPOUND
12-Nitro-9,12-octadecadienoate HMDB
12-Nitro-9,12-octadecadienoic acid HMDB
LNO2 HMDB
Manual Xrefs Databases
C13800 KEGG COMPOUND
HMDB0005049 HMDB
LNA PDBeChem
View more database links
Registry Number Type Source
774603-04-2 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations Types Sources
16227625 PubMed citation Europe PMC
16537525 PubMed citation Europe PMC
Last Modified
23 February 2022