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CHEBI:80434 - Cyanidin 5-O-glucoside

ChEBI IDCHEBI:80434
ChEBI NameCyanidin 5-O-glucoside
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FormulaC21H21O11
Net Charge+1
Average Mass449.388
Monoisotopic Mass449.10784
SMILESOC[C@H]1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)c(O)c4)c(O)cc23)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-5-9(23)4-14-10(15)6-13(26)20(30-14)8-1-2-11(24)12(25)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17-,18+,19-,21-/m1/s1
InChIKeyPWORRIQTGXEXBH-GQUPQBGVSA-O
ChEBI Ontology
Outgoing Relation(s)
Cyanidin 5-O-glucoside (CHEBI:80434) is a anthocyanidin glycoside (CHEBI:71583)
Manual XrefsDatabases
C16298KEGG COMPOUND