CHEBI:27978 - 3,4-dihydroxyphenylacetaldehyde

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ChEBI Name 3,4-dihydroxyphenylacetaldehyde
Definition A phenylacetaldehyde in which the 3 and 4 positions of the phenyl group are substituted by hydroxy groups.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1385, CHEBI:19888
Supplier Information
Download Molfile XML SDF
Formula C8H8O3
Net Charge 0
Average Mass 152.14730
Monoisotopic Mass 152.04734
InChI InChI=1S/C8H8O3/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,4-5,10-11H,3H2
SMILES [H]C(=O)Cc1ccc(O)c(O)c1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:txid562) See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) has role Escherichia coli metabolite (CHEBI:76971)
3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) has role human metabolite (CHEBI:77746)
3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) has role mouse metabolite (CHEBI:75771)
3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) is a α-CH2-containing aldehyde (CHEBI:73359)
3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) is a catechols (CHEBI:33566)
3,4-dihydroxyphenylacetaldehyde (CHEBI:27978) is a phenylacetaldehydes (CHEBI:25973)
Synonyms Sources
2-(3,4-dihydroxyphenyl)ethanal ChEBI
3,4-Dihydroxyphenylacetaldehyde KEGG COMPOUND
3,4-dihydroxyphenylacetaldehyde UniProt
Protocatechuatealdehyde KEGG COMPOUND
Manual Xref Database
View more database links
Registry Numbers Types Sources
1941234 Reaxys Registry Number Reaxys
5707-55-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12729575 PubMed citation Europe PMC
14556942 PubMed citation Europe PMC
17379813 PubMed citation Europe PMC
19537779 PubMed citation Europe PMC
Last Modified
27 January 2016
General Comment
2011-01-13 3,4-dihydroxyphenylacetaldehyde is a metabolite of the neurotransmitter dopamine.