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CHEBI:2971 - backebergine

ChEBI IDCHEBI:2971
ChEBI Namebackebergine
Stars
DefinitionA member of the class of isoquinolines carrying two methoxy substituents at positions 6 and 7.
Last Modified11 February 2015
DownloadsMolfile
FormulaC11H11NO2
Net Charge0
Average Mass189.214
Monoisotopic Mass189.07898
SMILESCOc1cc2ccncc2cc1OC
InChIInChI=1S/C11H11NO2/c1-13-10-5-8-3-4-12-7-9(8)6-11(10)14-2/h3-7H,1-2H3
InChIKeyJAJVYESKUNMYPN-UHFFFAOYSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
backebergine (CHEBI:2971) has role plant metabolite (CHEBI:76924)
backebergine (CHEBI:2971) is a isoquinoline alkaloid (CHEBI:24921)
backebergine (CHEBI:2971) is a isoquinolines (CHEBI:24922)
IUPAC Name 
6,7-dimethoxyisoquinoline
Synonym  Source
BackebergineKEGG COMPOUND
Manual XrefsDatabases
C09348KEGG COMPOUND
C00001815KNApSAcK
Registry NumbersSources
Reaxys:129335Reaxys
CAS:15248-39-2KEGG COMPOUND
CAS:15248-39-2ChemIDplus
Citations