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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 4-chloro-1,5-dihydroxy-3-hydroxymethyl-6-methoxycarbonyl-xanthen-9-one
ChEBI ID CHEBI:205033
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H11ClO7
Net Charge 0
Average Mass 350.710
Monoisotopic Mass 350.01933
InChI InChI=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
InChIKey ZURCVPJRADWJSG-UHFFFAOYSA-N
SMILES ClC1=C2OC3=C(O)C(C(=O)OC)=CC=C3C(C2=C(O)C=C1CO)=O
Metabolite of Species Details
Alternaria (NCBI:txid5598) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
35517143 ChemSpider
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