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Petunidin

C16H13O7+ 317.27 g/mol
O H O H O O + O H O H H O
Name Petunidin
Alternative name Phytohub ID PHUB001285
Formula C16H13O7+
Formula Weight 317.27 g/mol
Molecular Weight 317.27 g/mol
Monoisotopic Mass 317.066000 g/mol
InChI Key AFOLOMGWVXKIQL-UHFFFAOYSA-O
IUPAC 2-(3,4-dihydroxy-5-methoxyphenyl)chromenylium-3,5,7-triol
InChI InChI=1S/C16H12O7/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16/h2-6H,1H3,(H4-,17,18,19,20,21)/p+1
SMILES COC1=C(O)C(O)=CC(=C1)C1=[O+]C2=CC(O)=CC(O)=C2C=C1O
Food Berry
Food Source Blueberry
Family Phenolic
Class Flavonoid
Subclass Group Coumarin derivative
Subclass Anthocyanin
Metabolite Anthocyanin metabolite
CASNO 13270-60-5
HMDB HMDB0003173
PubChem 441774
KEGG C08727
FooDB FDB002755
DrugBank DB01904
ChEBI 75318
BioCyc CPD-15003
METLIN 3462.0