CHEBI:9601 - Tinctorine

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ChEBI Name Tinctorine
ChEBI ID CHEBI:9601
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H20N2O
Net Charge 0
Average Mass 244.333
Monoisotopic Mass 244.15756
InChI InChI=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
InChIKey VUJISNFQYSHCGH-WXRRBKDZSA-N
SMILES CN1C[C@@H]2C[C@H](Cn3c2cccc3=O)[C@H]1CC=C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing Tinctorine (CHEBI:9601) is a alkaloid (CHEBI:22315)
Synonym Source
Tinctorine KEGG COMPOUND
Manual Xrefs Databases
C00002239 KNApSAcK
C10790 KEGG COMPOUND
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Registry Number Type Source
33023-11-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014