CHEBI:171953 - 4-Acetyl-1,4-dimethyl-1-cyclohexene

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ChEBI Name 4-Acetyl-1,4-dimethyl-1-cyclohexene
ChEBI ID CHEBI:171953
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H16O
Net Charge 0
Average Mass 152.237
Monoisotopic Mass 152.12012
InChI InChI=1S/C10H16O/c1-8-4-6-10(3,7-5-8)9(2)11/h4H,5-7H2,1-3H3
InChIKey BIUSXTISNNLMOR-UHFFFAOYSA-N
SMILES O=C(C1(CCC(=CC1)C)C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing 4-Acetyl-1,4-dimethyl-1-cyclohexene (CHEBI:171953) is a ketone (CHEBI:17087)
IUPAC Name
1-(1,4-dimethylcyclohex-3-en-1-yl)ethanone
Manual Xrefs Databases
58780 ChemSpider
HMDB0037024 HMDB
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Registry Number Type Source
43219-68-7 CAS Registry Number ChemIDplus