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> Main
CHEBI:37107 - 7-methyl-3-oxooctanoic acid
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ChEBI Ontology
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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.
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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 (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
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