CHEBI:64264 - 3-isopropenyl-6-oxoheptanoic acid

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ChEBI Name 3-isopropenyl-6-oxoheptanoic acid ChEBI ID CHEBI:64264 Definition A 6-oxo monocarboxylic acid that is heptanoic acid bearing isopropenyl and oxo substituents at positions 3 and 6 respectively. 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 C10H16O3 Net Charge 0 Average Mass 184.23220 Monoisotopic Mass 184.10994 InChI InChI=1S/C10H16O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h9H,1,4-6H2,2-3H3,(H,12,13) InChIKey NJOIWWRMLFSDTM-UHFFFAOYSA-N SMILES CC(=C)C(CCC(C)=O)CC(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) has functional parent heptanoic acid (CHEBI:45571) 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) is a 6-oxo monocarboxylic acid (CHEBI:35960) 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) is conjugate acid of 3-isopropenyl-6-oxoheptanoate (CHEBI:64234) Incoming (3R)-3-isopropenyl-6-oxoheptanoic acid (CHEBI:37287) is a 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) (3S)-3-isopropenyl-6-oxoheptanoic acid (CHEBI:37291) is a 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) 3-isopropenyl-6-oxoheptanoate (CHEBI:64234) is conjugate base of 3-isopropenyl-6-oxoheptanoic acid (CHEBI:64264) IUPAC Name 6-oxo-3-(prop-1-en-2-yl)heptanoic acid Synonym Source limononic acid ChEBI Manual Xref Database 3-Isopropenyl-6-oxoheptanoates MetaCyc View more database links Citation Type Source 16475339 PubMed citation Europe PMC Last Modified 21 March 2012