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CHEBI:186691 - Dinor-10-NO2-CLA

ChEBI IDCHEBI:186691
ChEBI NameDinor-10-NO2-CLA
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H27NO4
Net Charge0
Average Mass297.395
Monoisotopic Mass297.19401
SMILESCCCCCC/C(=C\C=C\CCCCCC(=O)O)[N+](=O)[O-]
InChIInChI=1S/C16H27NO4/c1-2-3-4-9-12-15(17(20)21)13-10-7-5-6-8-11-14-16(18)19/h7,10,13H,2-6,8-9,11-12,14H2,1H3,(H,18,19)/b10-7+,15-13+
InChIKeyPXADSXFEFVVZKW-GRVINKSSSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dinor-10-NO2-CLA (CHEBI:186691) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(7E,9E)-10-nitrohexadeca-7,9-dienoic acid
Manual XrefsDatabases
113368358ChemSpider
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