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CHEBI:15621 - (4-hydroxyphenyl)acetaldehyde

ChEBI IDCHEBI:15621
ChEBI Name(4-hydroxyphenyl)acetaldehyde
Stars
Secondary ChEBI IDsCHEBI:1872, CHEBI:10899, CHEBI:12012, CHEBI:20417
Last Modified27 January 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H8O2
Net Charge0
Average Mass136.150
Monoisotopic Mass136.05243
SMILES[H]C(=O)Cc1ccc(O)cc1
InChIInChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2
InChIKeyIPRPPFIAVHPVJH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
(4-hydroxyphenyl)acetaldehyde (CHEBI:15621) has role Escherichia coli metabolite (CHEBI:76971)
(4-hydroxyphenyl)acetaldehyde (CHEBI:15621) has role human metabolite (CHEBI:77746)
(4-hydroxyphenyl)acetaldehyde (CHEBI:15621) has role mouse metabolite (CHEBI:75771)
(4-hydroxyphenyl)acetaldehyde (CHEBI:15621) is a phenylacetaldehydes (CHEBI:25973)
(4-hydroxyphenyl)acetaldehyde (CHEBI:15621) is a α-CH2-containing aldehyde (CHEBI:73359)
IUPAC Name 
(4-hydroxyphenyl)acetaldehyde
Synonyms  Source
4-HydroxyphenylacetaldehydeKEGG COMPOUND
2-(4-Hydroxyphenyl)acetaldehydeKEGG COMPOUND
p-HydroxyphenylacetaldehydeChemIDplus
pOH-Ph-CH2CHOChemIDplus
UniProt Name  Source
(4-hydroxyphenyl)acetaldehydeUniProt
Manual XrefsDatabases
C03765KEGG COMPOUND
Registry NumbersSources
CAS:7339-87-9ChemIDplus
CAS:7339-87-9KEGG COMPOUND