CHEBI:86285 - (9E)-10-nitrooctadecenoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (9E)-10-nitrooctadecenoic acid
ChEBI ID CHEBI:86285
ChEBI ASCII Name (9E)-10-nitrooctadecenoic acid
Definition A nitro fatty acid that is (9E)-octadec-9-enoic (elaidic) acid substituted by a nitro group at position 10.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H33NO4
Net Charge 0
Average Mass 327.45890
Monoisotopic Mass 327.24096
InChI InChI=1S/C18H33NO4/c1-2-3-4-5-8-11-14-17(19(22)23)15-12-9-6-7-10-13-16-18(20)21/h15H,2-14,16H2,1H3,(H,20,21)/b17-15+
InChIKey WRADPCFZZWXOTI-BMRADRMJSA-N
SMILES CCCCCCCC\C(=C/CCCCCCCC(O)=O)[N+]([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (9E)-10-nitrooctadecenoic acid (CHEBI:86285) has functional parent elaidic acid (CHEBI:27997)
(9E)-10-nitrooctadecenoic acid (CHEBI:86285) has role human metabolite (CHEBI:77746)
(9E)-10-nitrooctadecenoic acid (CHEBI:86285) is a long-chain fatty acid (CHEBI:15904)
(9E)-10-nitrooctadecenoic acid (CHEBI:86285) is a monounsaturated fatty acid (CHEBI:25413)
(9E)-10-nitrooctadecenoic acid (CHEBI:86285) is a nitro fatty acid (CHEBI:86286)
IUPAC Name
(9E)-10-nitrooctadec-9-enoic acid
Synonyms Sources
(E)-10-nitrooctadec-9-enoic acid ChEBI
10-nitro-9E-octadecenoic acid LIPID MAPS
10-nitroelaidic acid ChEBI
Manual Xref Database
LMFA01120003 LIPID MAPS
View more database links
Registry Number Type Source
10378886 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
25502724 PubMed citation Europe PMC
Last Modified
22 January 2016