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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:16582 - oxaluric acid
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ChEBI Ontology
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ChEBI Name
oxaluric acid
ChEBI ID
CHEBI:16582
Definition
A 2-oxo monocarboxylic acid that is amino(oxo)acetic acid substituted by a carbamoylamino group at the nitrogen atom.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:7816, CHEBI:14706, CHEBI:25737
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Formula
C3H4N2O4
Net Charge
0
Average Mass
132.07494
Monoisotopic Mass
132.01711
InChI
InChI=1S/C3H4N2O4/c4-3(9)5-1(6)2(7)8/h(H,7,8)(H3,4,5,6,9)
InChIKey
UWBHMRBRLOJJAA-UHFFFAOYSA-N
SMILES
NC(=O)NC(=O)C(O)=O
Metabolite of Species
Details
Escherichia coli
(NCBI:txid562)
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):
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in
Escherichia coli
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
oxaluric acid (
CHEBI:16582
)
has role
Escherichia coli
metabolite (
CHEBI:76971
)
oxaluric acid (
CHEBI:16582
)
is a
2-oxo monocarboxylic acid (
CHEBI:35910
)
oxaluric acid (
CHEBI:16582
)
is a
ureas (
CHEBI:47857
)
oxaluric acid (
CHEBI:16582
)
is conjugate acid of
oxalurate (
CHEBI:57824
)
Incoming
oxalurate (
CHEBI:57824
)
is conjugate base of
oxaluric acid (
CHEBI:16582
)
IUPAC Name
(carbamoylamino)(oxo)acetic acid
Synonyms
Sources
Monooxalylurea
KEGG COMPOUND
onooxalylurea
ChEBI
oxal
ChEBI
Oxalurate
KEGG COMPOUND
Oxalureate
KEGG COMPOUND
Oxaluric acid
KEGG COMPOUND
ureido(oxo)acetic acid
ChEBI
Manual Xrefs
Databases
C00007463
KNApSAcK
C00802
KEGG COMPOUND
CPD-389
MetaCyc
ECMDB20181
ECMDB
View more database links
Registry Numbers
Types
Sources
1769145
Reaxys Registry Number
Reaxys
585-05-7
CAS Registry Number
KEGG COMPOUND
585-05-7
CAS Registry Number
ChemIDplus
Citations
Types
Sources
22583701
PubMed citation
Europe PMC
23284870
PubMed citation
Europe PMC
Last Modified
25 January 2016