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CHEBI:197699 - Calocerin C

Default Structure
ChEBI IDCHEBI:197699
ChEBI NameCalocerin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H8ClNO3
Net Charge0
Average Mass237.642
Monoisotopic Mass237.01927
SMILESNC(=O)c1ccc2c(c1)C=CO/C(=C\Cl)O2
InChIInChI=1S/C11H8ClNO3/c12-6-10-15-4-3-7-5-8(11(13)14)1-2-9(7)16-10/h1-6H,(H2,13,14)/b10-6+
InChIKeySBGGYNNFSVGKKF-UXBLZVDNSA-N
Species of MetaboliteComponentSourceComments
Favolaschia calocera (ncbitaxon:181918) - PubMed (27745908)
ChEBI Ontology
Outgoing Relation(s)
Calocerin C (CHEBI:197699) is a benzenoid aromatic compound (CHEBI:33836)
IUPAC Name 
(2E)-2-(chloromethylidene)-1,3-benzodioxepine-7-carboxamide
Manual XrefsDatabases
78435835ChemSpider