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> Main
CHEBI:89963 - butyrylglycine
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ChEBI Name
butyrylglycine
ChEBI ID
CHEBI:89963
Definition
A
N
-acylglycine obtained by formal condensation of the carboxy group of butyric acid with the amino group of glycine.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C6H11NO3
Net Charge
0
Average Mass
145.157
Monoisotopic Mass
145.07389
InChI
InChI=1S/C6H11NO3/c1-2-3-5(8)7-4-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10)
InChIKey
WPSSBBPLVMTKRN-UHFFFAOYSA-N
SMILES
C(CNC(=O)CCC)(=O)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
butyrylglycine (
CHEBI:89963
)
has functional parent
butyric acid (
CHEBI:30772
)
butyrylglycine (
CHEBI:89963
)
has role
human urinary metabolite (
CHEBI:84087
)
butyrylglycine (
CHEBI:89963
)
is a
N
-acylglycine (
CHEBI:16180
)
butyrylglycine (
CHEBI:89963
)
is conjugate acid of
butyrylglycinate (
CHEBI:132937
)
Incoming
butyrylglycinate (
CHEBI:132937
)
is conjugate base of
butyrylglycine (
CHEBI:89963
)
IUPAC Name
N
-butanoylglycine
Synonyms
Sources
2-butanamidoacetic acid
HMDB
2-butyramidoacetic acid
ChEBI
butanamidoacetic acid
ChEBI
butyramidoacetic acid
ChEBI
N-(1-Oxobutyl)glycine
HMDB
N-Butyryl-Glycine
HMDB
N-Butyrylglycine
ChemIDplus
Manual Xref
Database
HMDB0000808
HMDB
View more database links
Registry Numbers
Types
Sources
1766058
Reaxys Registry Number
Reaxys
20208-73-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10404733
PubMed citation
Europe PMC
7815229
PubMed citation
Europe PMC
8548022
PubMed citation
Europe PMC
9932958
PubMed citation
Europe PMC
Last Modified
08 August 2016