CHEBI:18086 - indol-3-ylacetaldehyde

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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 ZINC000008216889 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H9NO Net Charge 0 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. View more via ChEBI Ontology 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 Synonyms Sources 1H-Indole-3-acetaldehyde ChemIDplus 2-(Indol-3-yl)acetaldehyde KEGG COMPOUND Indole-3-acetaldehyde KEGG COMPOUND indole-3-acetaldehyde UniProt Indoleacetaldehyde KEGG COMPOUND Manual Xrefs Databases C00000109 KNApSAcK C00637 KEGG COMPOUND HMDB0001190 HMDB INDOLE_ACETALDEHYDE MetaCyc View more database links Registry Numbers Types Sources 121586 Reaxys Registry Number Reaxys 2591-98-2 CAS Registry Number KEGG COMPOUND 2591-98-2 CAS Registry Number ChemIDplus Citations Last Modified 27 January 2016