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CHEBI:176003 - Flacourtin

ChEBI IDCHEBI:176003
ChEBI NameFlacourtin
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FormulaC20H22O9
Net Charge0
Average Mass406.387
Monoisotopic Mass406.12638
SMILESO=C(OCC1OC(Oc2ccc(CO)c(O)c2)C(O)C(O)C1O)c1ccccc1
InChIInChI=1S/C20H22O9/c21-9-12-6-7-13(8-14(12)22)28-20-18(25)17(24)16(23)15(29-20)10-27-19(26)11-4-2-1-3-5-11/h1-8,15-18,20-25H,9-10H2
InChIKeyYUHCIIZKQMLHKK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Flacourtin (CHEBI:176003) is a glycoside (CHEBI:24400)
IUPAC Name 
[3,4,5-trihydroxy-6-[3-hydroxy-4-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate
Manual XrefsDatabases
HMDB0039172HMDB