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CHEBI:201887 - Sescandelin B

ChEBI IDCHEBI:201887
ChEBI NameSescandelin B
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FormulaC11H10O5
Net Charge0
Average Mass222.196
Monoisotopic Mass222.05282
SMILESCc1oc(=O)c2c(O)cc(O)cc2c1CO
InChIInChI=1S/C11H10O5/c1-5-8(4-12)7-2-6(13)3-9(14)10(7)11(15)16-5/h2-3,12-14H,4H2,1H3
InChIKeySIGBMSMENCGPQO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Sescandelin B (CHEBI:201887) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6,8-dihydroxy-4-(hydroxymethyl)-3-methylisochromen-1-one
Manual XrefsDatabases
57473000ChemSpider