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CHEBI:66005 - N2-methylharmine

ChEBI IDCHEBI:66005
ChEBI NameN2-methylharmine
Stars
ASCII NameN(2)-methylharmine
DefinitionA member of the class of β-carbolines that is 9H-β-carboline substituted by a methoxy group at position 7 and methyl groups at positions 1 and 2. It is a semisynthetic derivative of harmine and has been shown to exhibit significant anti-HIV activity.
Last Modified10 May 2016
DownloadsMolfile
FormulaC14H14N2O
Net Charge0
Average Mass226.279
Monoisotopic Mass226.11061
SMILESCOc1ccc2c3ccn(C)c(C)c-3nc2c1
InChIInChI=1S/C14H14N2O/c1-9-14-12(6-7-16(9)2)11-5-4-10(17-3)8-13(11)15-14/h4-8H,1-3H3
InChIKeySNPOLGTUMADPOR-UHFFFAOYSA-N
Roles Classification
Biological Role:
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
ChEBI Ontology
Outgoing Relation(s)
N2-methylharmine (CHEBI:66005) has functional parent harmine (CHEBI:28121)
N2-methylharmine (CHEBI:66005) has role anti-HIV agent (CHEBI:64946)
N2-methylharmine (CHEBI:66005) is a aromatic ether (CHEBI:35618)
N2-methylharmine (CHEBI:66005) is a semisynthetic derivative (CHEBI:72588)
N2-methylharmine (CHEBI:66005) is a β-carbolines (CHEBI:60834)
IUPAC Name 
7-methoxy-1,2-dimethyl-2H-β-carboline
Synonym  Source
7-methoxy-1,2-dimethyl-2H-pyrido[3,4-b]indoleChEBI
Registry NumbersSources
Reaxys:15521Reaxys
CAS:6519-18-2ChemIDplus
Citations