CHEBI:182772 - 2-Methyldopamine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Methyldopamine
ChEBI ID CHEBI:182772
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H13NO2
Net Charge 0
Average Mass 167.208
Monoisotopic Mass 167.09463
InChI InChI=1S/C9H13NO2/c1-6-7(4-5-10)2-3-8(11)9(6)12/h2-3,11-12H,4-5,10H2,1H3
InChIKey NSEVRAZZUOXAHQ-UHFFFAOYSA-N
SMILES OC=1C(=C(CCN)C=CC1O)C
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): molecular messenger

(via monoamine molecular messenger )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-Methyldopamine (CHEBI:182772) is a catecholamine (CHEBI:33567)
IUPAC Name
4-(2-aminoethyl)-3-methylbenzene-1,2-diol
Manual Xref Database
61670 ChemSpider
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Registry Number Type Source
53622-73-4 CAS Registry Number ChemIDplus