CHEBI:17866 - digallate

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ChEBI Name digallate ChEBI ID CHEBI:17866 Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:14142, CHEBI:23722 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H9O9 Net Charge -1 Average Mass 321.21586 Monoisotopic Mass 321.02521 InChI InChI=1S/C14H10O9/c15-7-2-6(3-8(16)11(7)18)14(22)23-10-4-5(13(20)21)1-9(17)12(10)19/h1-4,15-19H,(H,20,21)/p-1 InChIKey COVFEVWNJUOYRL-UHFFFAOYSA-M SMILES Oc1cc(cc(O)c1O)C(=O)Oc1cc(cc(O)c1O)C([O-])=O ChEBI Ontology Outgoing digallate (CHEBI:17866) is a trihydroxybenzoate (CHEBI:36085) digallate (CHEBI:17866) is conjugate base of digallic acid (CHEBI:30814) Incoming digallic acid (CHEBI:30814) is conjugate acid of digallate (CHEBI:17866) IUPAC Name 3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyloxy)benzoate Synonym Source digallate UniProt Manual Xref Database C01572 KEGG COMPOUND View more database links Last Modified 28 May 2015