CHEBI:90333 - (E)-3-(indol-2-yl)acrylic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name (E)-3-(indol-2-yl)acrylic acid ChEBI ID CHEBI:90333 ChEBI ASCII Name (E)-3-(indol-2-yl)acrylic acid Definition An α,β-unsaturated monocarboxylic acid that is acrylic acid in which one of the hydrogens at position 3 is replaced by an indol-2-yl group. 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 C11H9NO2 Net Charge 0 Average Mass 187.195 Monoisotopic Mass 187.06333 InChI InChI=1S/C11H9NO2/c13-11(14)6-5-9-7-8-3-1-2-4-10(8)12-9/h1-7,12H,(H,13,14)/b6-5+ InChIKey SXOUIMVOMIGLHO-AATRIKPKSA-N SMILES C=1C=CC2=C(C1)C=C(N2)/C=C/C(=O)O Metabolite of Species Details Mus musculus (NCBI:txid10090) See: MetaboLights Study Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing (E)-3-(indol-2-yl)acrylic acid (CHEBI:90333) has functional parent acrylic acid (CHEBI:18308) (E)-3-(indol-2-yl)acrylic acid (CHEBI:90333) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020) (E)-3-(indol-2-yl)acrylic acid (CHEBI:90333) is a indoles (CHEBI:24828) IUPAC Name (2E)-3-(1H-indol-2-yl)prop-2-enoic acid Synonyms Sources 2-indoleacrylic acid ChEBI 2-indolylacrylic acid ChEBI 3-(2-indolyl)acrylic acid ChEBI indole-2-acrylic acid ChEBI indoleacrylic acid ChEBI trans-2-indoleacrylic acid ChEBI Manual Xref Database HMDB0000734 HMDB View more database links Registry Number Type Source 4397595 Reaxys Registry Number Reaxys Last Modified 23 June 2016