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Malvidin-3-o-arabinoside

C22H23ClO11 498.9 g/mol
O O H O O O O H O H H O H O O O H O O H O H H O O H O +
Name Malvidin-3-o-arabinoside
Alternative name Malvidin-3-O-arabinoside chloride
Formula C22H23ClO11
Formula Weight 498.90 g/mol
Molecular Weight 498.90 g/mol
Monoisotopic Mass 498.093000 g/mol
InChI Key FXWDXPVECLXGRZ-XIGYXKQDSA-N
IUPAC (2S,3R,4S,5S)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxyoxane-3,4,5-triol;chloride
InChI InChI=1S/C29H34O17/c1-40-15-3-10(4-16(41-2)20(15)33)27-17(44-29-26(39)24(37)22(35)19(9-31)46-29)7-12-13(42-27)5-11(32)6-14(12)43-28-25(38)23(36)21(34)18(8-30)45-28/h3-7,18-19,21-26,28-31,34-39H,8-9H2,1-2H3,(H-,32,33)/p+1
SMILES COC1=CC(=CC(OC)=C1O)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C(OC3OC(CO)C(O)C(O)C3O)=CC(O)=CC2=[O+]1
Food Berry, 
Food Source Blueberry, 
Family Phenolic
Class Flavonoid
Subclass Group Coumarin derivative
Subclass Anthocyanin
Metabolite Anthocyanin metabolite
CASNO 28500-04-1
HMDB HMDB0038009
PubChem 91810654
KEGG C12140
FooDB FDB017211
DrugBank DB01904
ChEBI 31799
BioCyc CPD1F-766
METLIN 3462.0