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CHEBI:81153 - 11-o-Galloylbergenin

ChEBI IDCHEBI:81153
ChEBI Name11-o-Galloylbergenin
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FormulaC21H20O13
Net Charge0
Average Mass480.378
Monoisotopic Mass480.09039
SMILESCOc1c(O)cc2c(c1O)C1OC(COC(=O)c3cc(O)c(O)c(O)c3)C(O)C(O)C1OC2=O
InChIInChI=1S/C21H20O13/c1-31-17-10(24)4-7-12(15(17)27)18-19(34-21(7)30)16(28)14(26)11(33-18)5-32-20(29)6-2-8(22)13(25)9(23)3-6/h2-4,11,14,16,18-19,22-28H,5H2,1H3
InChIKeyCDRRULDABVKKHU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
11-o-Galloylbergenin (CHEBI:81153) is a trihydroxybenzoic acid (CHEBI:27115)
Manual XrefsDatabases
C17520KEGG COMPOUND