CHEBI:125490 - 5-(2-aminoethyl)-6-methylbenzene-1,2,4-triol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(2-aminoethyl)-6-methylbenzene-1,2,4-triol
ChEBI ID CHEBI:125490
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C9H13NO3
Net Charge 0
Average Mass 183.205
Monoisotopic Mass 183.090
InChI InChI=1S/C9H13NO3/c1-5-6(2-3-10)7(11)4-8(12)9(5)13/h4,11-13H,2-3,10H2,1H3
InChIKey WWYQEGUUFKELML-UHFFFAOYSA-N
SMILES CC1=C(C(=CC(=C1O)O)O)CCN
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 5-(2-aminoethyl)-6-methylbenzene-1,2,4-triol (CHEBI:125490) is a catecholamine (CHEBI:33567)
Manual Xref Database
LSM-36990 LINCS
View more database links