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ChEBI
> Main
CHEBI:74911 - methyl
N
-acetylvalinate
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ChEBI Name
methyl
N
-acetylvalinate
ChEBI ID
CHEBI:74911
ChEBI ASCII Name
methyl N-acetylvalinate
Definition
A valine derivative with one of the amine hydrogens replaced by an acetyl group and the carboxylic acid hydrogen replaced by a methyl group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C8H15NO3
Net Charge
0
Average Mass
173.20960
Monoisotopic Mass
173.10519
InChI
InChI=1S/C8H15NO3/c1-5(2)7(8(11)12-4)9-6(3)10/h5,7H,1-4H3,(H,9,10)
InChIKey
KCHNPFJMSOGXIT-UHFFFAOYSA-N
SMILES
COC(=O)C(NC(C)=O)C(C)C
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
methyl
N
-acetylvalinate (
CHEBI:74911
)
has role
metabolite (
CHEBI:25212
)
methyl
N
-acetylvalinate (
CHEBI:74911
)
is a
valine derivative (
CHEBI:27267
)
IUPAC Name
methyl
N
-acetylvalinate
Synonyms
Sources
Ac-Val-OMe
ChEBI
N
-acetylvaline methyl ester
ChEBI
Registry Number
Type
Source
1864924
Reaxys Registry Number
Reaxys
Last Modified
02 September 2013