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CHEBI:224466 - Wentiquinone C

ChEBI IDCHEBI:224466
ChEBI NameWentiquinone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12O7
Net Charge0
Average Mass316.265
Monoisotopic Mass316.05830
SMILESCOc1cc(O)c2c(=O)c3c(O)cc(CO)cc3oc(=O)c2c1
InChIInChI=1S/C16H12O7/c1-22-8-4-9-13(11(19)5-8)15(20)14-10(18)2-7(6-17)3-12(14)23-16(9)21/h2-5,17-19H,6H2,1H3
InChIKeyUBSXDIYXWMXBRI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.phytol.2013.11.008)
ChEBI Ontology
Outgoing Relation(s)
Wentiquinone C (CHEBI:224466) is a oxacycle (CHEBI:38104)
IUPAC Name 
1,10-dihydroxy-3-(hydroxymethyl)-8-methoxybenzo[c][1]benzoxepine-6,11-dione
Manual XrefsDatabases
71116061ChemSpider