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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 11-(Methylthiono)canthin-6-one
ChEBI ID CHEBI:218021
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H10N2OS
Net Charge 0
Average Mass 266.320
Monoisotopic Mass 266.05138
InChI InChI=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
InChIKey WNKZMIHGWYGQLX-UHFFFAOYSA-N
SMILES S(C1=C2C(N3C(=O)C=CC=4C3=C2C=CN4)=CC=C1)C
Metabolite of Species Details
Pulveroboletus curtisii (NCBI:txid279516) See: DOI
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 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 Xref Database
9645943 ChemSpider
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