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CHEBI:4110 - cathinone

ChEBI IDCHEBI:4110
ChEBI Namecathinone
Stars
DefinitionThe S stereoisomer of 2-aminopropiophenone.
Last Modified28 July 2014
DownloadsMolfile
FormulaC9H11NO
Net Charge0
Average Mass149.193
Monoisotopic Mass149.08406
SMILESC[C@H](N)C(=O)c1ccccc1
InChIInChI=1S/C9H11NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7H,10H2,1H3/t7-/m0/s1
InChIKeyPUAQLLVFLMYYJJ-ZETCQYMHSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Applications:
central nervous system stimulant  Any drug that enhances the activity of the central nervous system.
psychotropic drug  A loosely defined grouping of drugs that have effects on psychological function.
ChEBI Ontology
Outgoing Relation(s)
cathinone (CHEBI:4110) has role central nervous system stimulant (CHEBI:35337)
cathinone (CHEBI:4110) has role psychotropic drug (CHEBI:35471)
cathinone (CHEBI:4110) is a 2-aminopropiophenone (CHEBI:59332)
cathinone (CHEBI:4110) is a monoamine alkaloid (CHEBI:59333)
IUPAC Name 
(2S)-2-amino-1-phenylpropan-1-one
INNs  Source
cathinoneChemIDplus
cathinonumChemIDplus
catinonaChemIDplus
Synonyms  Source
D-CathinoneKEGG COMPOUND
CathinoneKEGG COMPOUND
NorephedroneChemIDplus
Manual XrefsDatabases
C08301KEGG COMPOUND
DB01560DrugBank
C00001406KNApSAcK
Registry NumbersSources
CAS:71031-15-7KEGG COMPOUND
CAS:71031-15-7ChemIDplus