CHEBI:37107 - 7-methyl-3-oxooctanoic acid

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ChEBI Name 7-methyl-3-oxooctanoic acid
ChEBI ID CHEBI:37107
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H16O3
Net Charge 0
Average Mass 172.22154
Monoisotopic Mass 172.10994
InChI InChI=1S/C9H16O3/c1-7(2)4-3-5-8(10)6-9(11)12/h7H,3-6H2,1-2H3,(H,11,12)
InChIKey HMJVYQBHXHOGRX-UHFFFAOYSA-N
SMILES CC(C)CCCC(=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 )
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ChEBI Ontology
Outgoing 7-methyl-3-oxooctanoic acid (CHEBI:37107) has functional parent 7-methyloctanoic acid (CHEBI:37108)
7-methyl-3-oxooctanoic acid (CHEBI:37107) is a 3-oxo monocarboxylic acid (CHEBI:47881)
Incoming 7-methyl-3-oxooct-6-enoyl-CoA (CHEBI:52043) has functional parent 7-methyl-3-oxooctanoic acid (CHEBI:37107)
7-methyl-3-oxooctanoyl-CoA (CHEBI:15506) has functional parent 7-methyl-3-oxooctanoic acid (CHEBI:37107)
IUPAC Name
7-methyl-3-oxooctanoic acid
Registry Number Type Source
4858725 Beilstein Registry Number Beilstein
Last Modified
04 March 2009