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CHEBI:205033 - 4-chloro-1,5-dihydroxy-3-hydroxymethyl-6-methoxycarbonyl-xanthen-9-one

ChEBI IDCHEBI:205033
ChEBI Name4-chloro-1,5-dihydroxy-3-hydroxymethyl-6-methoxycarbonyl-xanthen-9-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H11ClO7
Net Charge0
Average Mass350.710
Monoisotopic Mass350.01933
SMILESCOC(=O)c1ccc2c(=O)c3c(O)cc(CO)c(Cl)c3oc2c1O
InChIInChI=1S/C16H11ClO7/c1-23-16(22)8-3-2-7-12(20)10-9(19)4-6(5-18)11(17)15(10)24-14(7)13(8)21/h2-4,18-19,21H,5H2,1H3
InChIKeyZURCVPJRADWJSG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternaria (ncbitaxon:5598) - PubMed (26204946)
ChEBI Ontology
Outgoing Relation(s)
4-chloro-1,5-dihydroxy-3-hydroxymethyl-6-methoxycarbonyl-xanthen-9-one (CHEBI:205033) is a xanthones (CHEBI:51149)
IUPAC Name 
methyl 5-chloro-4,8-dihydroxy-6-(hydroxymethyl)-9-oxoxanthene-3-carboxylate
Manual XrefsDatabases
35517143ChemSpider