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CHEBI:79976 - Anthocyanin 3'-O-beta-D-glucoside

Default Structure
ChEBI IDCHEBI:79976
ChEBI NameAnthocyanin 3'-O-beta-D-glucoside
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FormulaC21H21O7
Net Charge+1
Average Mass385.392
Monoisotopic Mass385.12818
SMILESOC[C@H]1O[C@@H](Oc2cc3ccccc3[o+]c2-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C21H21O7/c22-11-16-17(23)18(24)19(25)21(28-16)27-15-10-13-8-4-5-9-14(13)26-20(15)12-6-2-1-3-7-12/h1-10,16-19,21-25H,11H2/q+1/t16-,17-,18+,19-,21-/m1/s1
InChIKeyMEQJMMBFNYEOGP-GQUPQBGVSA-N
ChEBI Ontology
Outgoing Relation(s)
Anthocyanin 3'-O-beta-D-glucoside (CHEBI:79976) is a anthocyanidin glycoside (CHEBI:71583)
Manual XrefsDatabases
C15550KEGG COMPOUND