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CHEBI:189359 - 8-Amino-9-benzoyl-6H-thiepino[2,3-c]chromen-6-one

ChEBI IDCHEBI:189359
ChEBI Name8-Amino-9-benzoyl-6H-thiepino[2,3-c]chromen-6-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H13NO3S
Net Charge0
Average Mass347.395
Monoisotopic Mass347.06161
SMILESNC1=C(C(=O)c2ccccc2)C=Cc2c(c(=O)oc3ccccc23)S1
InChIInChI=1S/C20H13NO3S/c21-19-15(17(22)12-6-2-1-3-7-12)11-10-14-13-8-4-5-9-16(13)24-20(23)18(14)25-19/h1-11H,21H2
InChIKeyJNLLZMRJLHYHTH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
8-Amino-9-benzoyl-6H-thiepino[2,3-c]chromen-6-one (CHEBI:189359) is a coumarins (CHEBI:23403)
IUPAC Name 
8-amino-9-benzoylthiepino[2,3-c]chromen-6-one
Manual XrefsDatabases
496815ChemSpider