CHEBI:84226 - (3E)-2,3,4-trimethylhex-3-enal

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ChEBI Name (3E)-2,3,4-trimethylhex-3-enal ChEBI ID CHEBI:84226 ChEBI ASCII Name (3E)-2,3,4-trimethylhex-3-enal Definition A hexenal that is (3E)-hex-3-enal substituted by methyl groups at positions 2, 3 and 6. Metabolite observed in cancer metabolism. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H16O Net Charge 0 Average Mass 140.22270 Monoisotopic Mass 140.12012 InChI InChI=1S/C9H16O/c1-5-7(2)9(4)8(3)6-10/h6,8H,5H2,1-4H3/b9-7+ InChIKey BVVNPUJZXVWJAQ-VQHVLOKHSA-N SMILES CC\C(C)=C(/C)C(C)C=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Metabolite observed in cancer metabolism. See: PubMed Homo sapiens (NCBI:txid9606) See: MetaboLights Study Roles Classification 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 (3E)-2,3,4-trimethylhex-3-enal (CHEBI:84226) has role human metabolite (CHEBI:77746) (3E)-2,3,4-trimethylhex-3-enal (CHEBI:84226) is a hexenal (CHEBI:24578) IUPAC Name (3E)-2,3,4-trimethylhex-3-enal Citation Type Source 25518943 PubMed citation Europe PMC Last Modified 14 January 2015