CHEBI:78741 - oxidopamine

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ChEBI Name oxidopamine
ChEBI ID CHEBI:78741
Definition A benzenetriol that is phenethylamine in which the hydrogens at positions 2, 4, and 5 on the phenyl ring are replaced by hydroxy groups. It occurs naturally in human urine, but is also produced as a metabolite of the drug DOPA (used for the treatment of Parkinson's disease).
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C8H11NO3
Net Charge 0
Average Mass 169.17780
Monoisotopic Mass 169.074
InChI InChI=1S/C8H11NO3/c9-2-1-5-3-7(11)8(12)4-6(5)10/h3-4,10-12H,1-2,9H2
InChIKey DIVDFFZHCJEHGG-UHFFFAOYSA-N
SMILES NCCc1cc(O)c(O)cc1O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): neurotoxin
A poison that interferes with the functions of the nervous system.
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
drug metabolite

molecular messenger

(via monoamine molecular messenger )
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ChEBI Ontology
Outgoing oxidopamine (CHEBI:78741) has functional parent dopamine (CHEBI:18243)
oxidopamine (CHEBI:78741) has role drug metabolite (CHEBI:49103)
oxidopamine (CHEBI:78741) has role human metabolite (CHEBI:77746)
oxidopamine (CHEBI:78741) has role neurotoxin (CHEBI:50910)
oxidopamine (CHEBI:78741) is a benzenetriol (CHEBI:22707)
oxidopamine (CHEBI:78741) is a catecholamine (CHEBI:33567)
oxidopamine (CHEBI:78741) is a primary amino compound (CHEBI:50994)
IUPAC Name
5-(2-aminoethyl)benzene-1,2,4-triol
INNs Sources
oxidopamina ChemIDplus
oxidopamine WHO MedNet
oxidopamine ChemIDplus
oxidopaminum ChemIDplus
Synonyms Sources
2,4,5-trihydroxyphenethylamine ChemIDplus
6-hydroxydopamine ChemIDplus
6-OHDA ChemIDplus
hydroxydopamine MetaCyc
topamine ChEBI
Manual Xrefs Databases
CPD-7666 MetaCyc
D05294 KEGG DRUG
HMDB0001537 HMDB
LSM-37081 LINCS
Oxidopamine Wikipedia
View more database links
Registry Number Type Source
2211011 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12486162 PubMed citation Europe PMC
22789904 PubMed citation Europe PMC
23358137 PubMed citation Europe PMC
23670213 PubMed citation Europe PMC
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24277157 PubMed citation Europe PMC
24333330 PubMed citation Europe PMC
24885281 PubMed citation Europe PMC
8255370 PubMed citation Europe PMC
Last Modified
26 February 2016