N-(1H-Indol-3-ylacetyl)alanine (CHEBI:182337)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	N-(1H-Indol-3-ylacetyl)alanine

ChEBI ID	CHEBI:182337

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H14N2O3

Net Charge

Average Mass

246.266

Monoisotopic Mass

246.10044

InChI

InChI=1S/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)

InChIKey

FBDCJLXTUCMFLF-UHFFFAOYSA-N

SMILES

O=C(NC(C)C(O)=O)CC=1C=2C(NC1)=CC=CC2

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	N-(1H-Indol-3-ylacetyl)alanine (CHEBI:182337) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name

2-[[2-(1H-indol-3-yl)acetyl]amino]propanoic acid