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CHEBI:65727 - Decarine

ChEBI IDCHEBI:65727
ChEBI NameDecarine
Stars
DefinitionA natural product found particularly in Zanthoxylum caudatum and Zanthoxylum viride.
Last Modified22 September 2014
DownloadsMolfile
FormulaC19H13NO4
Net Charge0
Average Mass319.316
Monoisotopic Mass319.08446
SMILESCOc1c(O)ccc2c1cnc1c3cc4c(cc3ccc21)OCO4
InChIInChI=1S/C19H13NO4/c1-22-19-14-8-20-18-12(11(14)4-5-15(19)21)3-2-10-6-16-17(7-13(10)18)24-9-23-16/h2-8,21H,9H2,1H3
InChIKeyGJJFWGQGJJGJEO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zanthoxylum viride (IPNI:776103-1) - DOI (10.1016/0031-9422(75)83065-2)
Zanthoxylum syncarpum (IPNI:270795-2) stem (BTO:0001300) PubMed (14738394)
Zanthoxylum caudatum (IPNI:775639-1) - PubMed (11324918)
Zanthoxylum tetraspermum (IPNI:776057-1) - PubMed (11324918)
Zanthoxylum decaryi (IPNI:775686-1) - DOI (10.1016/0031-9422(74)80113-5)
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
Decarine (CHEBI:65727) has role metabolite (CHEBI:25212)
Decarine (CHEBI:65727) is a benzophenanthridine alkaloid (CHEBI:38517)
Synonyms  Source
1-methoxy[1,3]benzodioxolo[5,6-c]phenanthridin-2-olChEBI
RutacelineChEBI
Registry NumbersSources
CAS:54354-62-0ChemIDplus
Citations