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CHEBI:143533 - 2,6-dimethylheptanoate
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ChEBI Name
2,6-dimethylheptanoate
ChEBI ID
CHEBI:143533
Definition
A methyl-branched fatty acid anion that is the conjugate base of 2,6-dimethylheptanoic acid, arising from the deprotonation of the carboxy group.
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This entity has been manually annotated by the ChEBI Team.
Submitter
Lucila Aimo
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Formula
C9H17O2
Net Charge
-1
Average Mass
157.234
Monoisotopic Mass
157.12340
InChI
InChI=1S/C9H18O2/c1-7(2)5-4-6-8(3)9(10)11/h7-8H,4-6H2,1-3H3,(H,10,11)/p-1
InChIKey
MDAPKSVKYITQHQ-UHFFFAOYSA-M
SMILES
[O-]C(=O)C(CCCC(C)C)C
ChEBI Ontology
Outgoing
2,6-dimethylheptanoate (
CHEBI:143533
)
is a
medium-chain fatty acid anion (
CHEBI:59558
)
2,6-dimethylheptanoate (
CHEBI:143533
)
is a
methyl-branched fatty acid anion (
CHEBI:67013
)
2,6-dimethylheptanoate (
CHEBI:143533
)
is conjugate base of
2,6-dimethylheptanoic acid (
CHEBI:143886
)
Incoming
2,6-dimethylheptanoic acid (
CHEBI:143886
)
is conjugate acid of
2,6-dimethylheptanoate (
CHEBI:143533
)
IUPAC Name
2,6-dimethylheptanoate
Synonyms
Sources
2,6-dimethylheptanoate
UniProt
2,6-dimethylheptanoic acid(1−)
ChEBI
Citation
Type
Source
11785945
PubMed citation
SUBMITTER
Last Modified
11 June 2019