CHEBI:70811 - N-(indol-3-ylacetyl)glutamine

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ChEBI Name N-(indol-3-ylacetyl)glutamine
ChEBI ID CHEBI:70811
ChEBI ASCII Name N-(indol-3-ylacetyl)glutamine
Definition A N2-acylglutamine that has indol-3-ylacetyl as the acyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H17N3O4
Net Charge 0
Average Mass 303.31320
Monoisotopic Mass 303.12191
InChI InChI=1S/C15H17N3O4/c16-13(19)6-5-12(15(21)22)18-14(20)7-9-8-17-11-4-2-1-3-10(9)11/h1-4,8,12,17H,5-7H2,(H2,16,19)(H,18,20)(H,21,22)
InChIKey DVJIJAYHBZALOJ-UHFFFAOYSA-N
SMILES NC(=O)CCC(NC(=O)Cc1c[nH]c2ccccc12)C(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 (Bronsted 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 N-(indol-3-ylacetyl)glutamine (CHEBI:70811) has functional parent indole-3-acetic acid (CHEBI:16411)
N-(indol-3-ylacetyl)glutamine (CHEBI:70811) has role human urinary metabolite (CHEBI:84087)
N-(indol-3-ylacetyl)glutamine (CHEBI:70811) is a N2-acylglutamine (CHEBI:83985)
N-(indol-3-ylacetyl)glutamine (CHEBI:70811) is conjugate acid of N-(indol-3-ylacetyl)glutaminate (CHEBI:133730)
Incoming N-(indol-3-ylacetyl)glutaminate (CHEBI:133730) is conjugate base of N-(indol-3-ylacetyl)glutamine (CHEBI:70811)
IUPAC Names
5-amino-2-[(1H-indol-3-ylacetyl)amino]-5-oxopentanoic acid
N2-(1H-indol-3-ylacetyl)glutamine
Synonyms Sources
3-IAA glutamine HMDB
indole-3-acetyl-glutamine ChEBI
N-indoleacetylglutamine ChEBI
Manual Xref Database
HMDB0013240 HMDB
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Citation Waiting for Citations Type Source
22770225 PubMed citation Europe PMC
Last Modified
12 October 2016