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CHEBI:212694 - Circumdatin K

ChEBI IDCHEBI:212694
ChEBI NameCircumdatin K
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H11N3O3
Net Charge0
Average Mass293.282
Monoisotopic Mass293.08004
SMILESO=C1NCc2nc3c(O)cccc3c(=O)n2-c2ccccc21
InChIInChI=1S/C16H11N3O3/c20-12-7-3-5-10-14(12)18-13-8-17-15(21)9-4-1-2-6-11(9)19(13)16(10)22/h1-7,20H,8H2,(H,17,21)
InChIKeyKYEPZJDETIRBHT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (23701598)
ChEBI Ontology
Outgoing Relation(s)
Circumdatin K (CHEBI:212694) is a pyrimidodiazepine (CHEBI:39306)
IUPAC Name 
9-hydroxy-6,7-dihydroquinazolino[3,2-a][1,4]benzodiazepine-5,13-dione
Manual XrefsDatabases
29355859ChemSpider