indol-3-ylacetaldehyde (CHEBI:18086)

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ChEBI Name	indol-3-ylacetaldehyde

ChEBI ID	CHEBI:18086

Definition	An indoleacetaldehyde that is acetaldehyde in which one of the methyl hydrogens are replaced by a indol-3-yl group. It is an intermediate metabolite in the metabolism of tryptophan.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:24798, CHEBI:5902, CHEBI:14445, CHEBI:11477

Supplier Information

Download	Molfile XML SDF

Formula

C10H9NO

Net Charge

Average Mass

159.18460

Monoisotopic Mass

159.06841

InChI

InChI=1S/C10H9NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,6-7,11H,5H2

InChIKey

WHOOUMGHGSPMGR-UHFFFAOYSA-N

SMILES

O=CCc1c[nH]c2ccccc12

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed
Saccharomyces cerevisiae (NCBI:txid4932)	Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606)	See: DOI

Roles Classification
Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

ChEBI Ontology
Outgoing	indol-3-ylacetaldehyde (CHEBI:18086) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) indol-3-ylacetaldehyde (CHEBI:18086) has role bacterial metabolite (CHEBI:76969) indol-3-ylacetaldehyde (CHEBI:18086) has role human metabolite (CHEBI:77746) indol-3-ylacetaldehyde (CHEBI:18086) has role mouse metabolite (CHEBI:75771) indol-3-ylacetaldehyde (CHEBI:18086) is a indoleacetaldehyde (CHEBI:24823)

IUPAC Name

1H-indol-3-ylacetaldehyde

Last Modified

27 January 2016