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Petunidin 3-arabinoside

C21H21O10 433.385 g/mol
O H O O H O O H O H O O H O H O +
Name Petunidin 3-arabinoside
Alternative name Phytohub ID PHUB001285
Formula C21H21O10
Formula Weight 433.38 g/mol
Molecular Weight 433.38 g/mol
Monoisotopic Mass 433.113000 g/mol
InChI Key MVBYJYWJFIOZIW-UHFFFAOYSA-O
IUPAC 2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-1λ⁴-chromen-1-ylium
InChI InChI=1S/C21H20O10/c1-28-15-6-10(4-12(23)17(15)25)20-16(5-9-2-3-11(22)7-14(9)30-20)31-21-19(27)18(26)13(24)8-29-21/h2-7,13,18-19,21,24,26-27H,8H2,1H3,(H2-,22,23,25)/p+1
SMILES COC1=CC(=CC(O)=C1O)C1=C(OC2OCC(O)C(O)C2O)C=C2C=CC(O)=CC2=[O+]1
Food Berry, 
Food Source Blueberry, 
Family Phenolic
Class Flavonoid
Subclass Group Coumarin derivative
Subclass Anthocyanin
Metabolite Anthocyanin metabolite
CASNO 28500-03-0
HMDB HMDB0038094
PubChem 441774
KEGG C08727
FooDB FDB017314
DrugBank DB01904
ChEBI 75318
BioCyc CPD-15003
METLIN 3462.0