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CHEBI:218021 - 11-(Methylthiono)canthin-6-one

ChEBI IDCHEBI:218021
ChEBI Name11-(Methylthiono)canthin-6-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H10N2OS
Net Charge0
Average Mass266.325
Monoisotopic Mass266.05138
SMILESCSc1cccc2c1c1ccnc3ccc(=O)n2c31
InChIInChI=1S/C15H10N2OS/c1-19-12-4-2-3-11-14(12)9-7-8-16-10-5-6-13(18)17(11)15(9)10/h2-8H,1H3
InChIKeyWNKZMIHGWYGQLX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pulveroboletus curtisii (ncbitaxon:279516) - DOI (10.1002/ejoc.200400519)
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)
11-(Methylthiono)canthin-6-one (CHEBI:218021) is a alkaloid (CHEBI:22315)
11-(Methylthiono)canthin-6-one (CHEBI:218021) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name 
11-methylsulanyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
Manual XrefsDatabases
9645943ChemSpider