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CHEBI:198750 - Kynapcin-28

ChEBI IDCHEBI:198750
ChEBI NameKynapcin-28
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H12O10
Net Charge0
Average Mass400.295
Monoisotopic Mass400.04305
SMILESCOC(=O)c1oc2cc(O)c(O)cc2c1-c1c(C(=O)O)oc2cc(O)c(O)cc12
InChIInChI=1S/C19H12O10/c1-27-19(26)17-15(7-3-9(21)11(23)5-13(7)29-17)14-6-2-8(20)10(22)4-12(6)28-16(14)18(24)25/h2-5,20-23H,1H3,(H,24,25)
InChIKeyMOXBJFJTLKHZPO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Polyozellus multiplex (ncbitaxon:281719) - PubMed (12243451)
ChEBI Ontology
Outgoing Relation(s)
Kynapcin-28 (CHEBI:198750) is a benzofurans (CHEBI:35259)
IUPAC Name 
3-(5,6-dihydroxy-2-methoxycarbonyl-1-benzouran-3-yl)-5,6-dihydroxy-1-benzouran-2-carboxylic acid
Manual XrefsDatabases
8561694ChemSpider