CHEBI:133730 - N-(indol-3-ylacetyl)glutaminate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name N-(indol-3-ylacetyl)glutaminate ChEBI ID CHEBI:133730 ChEBI ASCII Name N-(indol-3-ylacetyl)glutaminate Definition A monocarboxylic acid anion that is the conjugate base of N-(indol-3-ylacetyl)glutamine, obtained by deprotonation of the carboxy group; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H16N3O4 Net Charge -1 Average Mass 302.306 Monoisotopic Mass 302.11463 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)/p-1 InChIKey DVJIJAYHBZALOJ-UHFFFAOYSA-M SMILES O=C([O-])C(NC(=O)CC=1C=2C=CC=CC2NC1)CCC(=O)N Roles Classification 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)glutaminate (CHEBI:133730) has role human urinary metabolite (CHEBI:84087) N-(indol-3-ylacetyl)glutaminate (CHEBI:133730) is a monocarboxylic acid anion (CHEBI:35757) N-(indol-3-ylacetyl)glutaminate (CHEBI:133730) is conjugate base of N-(indol-3-ylacetyl)glutamine (CHEBI:70811) Incoming N-(indol-3-ylacetyl)glutamine (CHEBI:70811) is conjugate acid of N-(indol-3-ylacetyl)glutaminate (CHEBI:133730) IUPAC Name 5-amino-2-[2-(1H-indol-3-yl)acetamido]-5-oxopentanoate Synonyms Sources indole-3-acetylglutaminate ChEBI N-indoleacetylglutaminate ChEBI N2-(1H-indol-3-ylacetyl)glutaminate IUPAC Last Modified 12 October 2016