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CHEBI:141317 - 2-phenylethyl 1H-indol-3-ylacetate

ChEBI IDCHEBI:141317
ChEBI Name2-phenylethyl 1H-indol-3-ylacetate
Stars
ASCII Name2-phenylethyl 1H-indol-3-ylacetate
DefinitionA carboxylic ester resulting from the formal condensation of the carboxy group of indole-3-acetic acid with the hydroxy group of 2-phenylethanol.
Last Modified17 August 2023
SubmitterR. Stephan
DownloadsMolfile
FormulaC18H17NO2
Net Charge0
Average Mass279.339
Monoisotopic Mass279.12593
SMILESO=C(Cc1cnc2ccccc12)OCCc1ccccc1
InChIInChI=1S/C18H17NO2/c20-18(21-11-10-14-6-2-1-3-7-14)12-15-13-19-17-9-5-4-8-16(15)17/h1-9,13,19H,10-12H2
InChIKeyIRHVVAKMDAHHAI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Colletotrichum gloeosporioides (ncbitaxon:474922) - PubMed (25421415)
Roles Classification
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
ChEBI Ontology
Outgoing Relation(s)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) has functional parent 2-phenylethanol (CHEBI:49000)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) has functional parent indole-3-acetic acid (CHEBI:16411)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) has role antifungal agent (CHEBI:35718)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) has role fungal metabolite (CHEBI:76946)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) is a carboxylic ester (CHEBI:33308)
2-phenylethyl 1H-indol-3-ylacetate (CHEBI:141317) is a indoles (CHEBI:24828)
IUPAC Name 
2-phenylethyl 1H-indol-3-ylacetate
Synonym  Source
2-phenylethyl 1H-indol-3-yl-acetateChEBI
Citations