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CHEBI:191895 - 2,3,6,7-Tetrahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one

ChEBI IDCHEBI:191895
ChEBI Name2,3,6,7-Tetrahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H15NO
Net Charge0
Average Mass177.247
Monoisotopic Mass177.11536
SMILESCC1C(=O)C2=C(C=CCCN2)C1C
InChIInChI=1S/C11H15NO/c1-7-8(2)11(13)10-9(7)5-3-4-6-12-10/h3,5,7-8,12H,4,6H2,1-2H3
InChIKeyIWVJMIGICFUHHO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) blood serum (BTO:0000133) MetaboLights (MTBLS4638)
ChEBI Ontology
Outgoing Relation(s)
2,3,6,7-Tetrahydro-6,7-dimethylcyclopent[b]azepin-8(1H)-one (CHEBI:191895) is a azepine (CHEBI:48105)
IUPAC Name 
6,7-dimethyl-2,3,6,7-tetrahydro-1H-cyclopenta[b]azepin-8-one
Manual XrefsDatabases
4934355ChemSpider