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CHEBI:9601 - Tinctorine

ChEBI IDCHEBI:9601
ChEBI NameTinctorine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20N2O
Net Charge0
Average Mass244.338
Monoisotopic Mass244.15756
SMILESC=CC[C@@H]1[C@@H]2C[C@H](CN1C)c1cccc(=O)n1C2
InChIInChI=1S/C15H20N2O/c1-3-5-13-12-8-11(9-16(13)2)14-6-4-7-15(18)17(14)10-12/h3-4,6-7,11-13H,1,5,8-10H2,2H3/t11?,12?,13-/m1/s1
InChIKeyVUJISNFQYSHCGH-WXRRBKDZSA-N
Roles Classification
Biological Role:
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)
Tinctorine (CHEBI:9601) is a alkaloid (CHEBI:22315)
Synonym  Source
TinctorineKEGG COMPOUND
Manual XrefsDatabases
C00002239KNApSAcK
C10790KEGG COMPOUND
Registry NumbersSources
CAS:33023-11-9KEGG COMPOUND