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Delphinidin 3-arabinoside

C20H19O11 435.358 g/mol
H O O O O H O H O + H O H O O H O H O H
Name Delphinidin 3-arabinoside
Alternative name Delphinidin chloride
Formula C20H19O11
Formula Weight 435.36 g/mol
Molecular Weight 435.36 g/mol
Monoisotopic Mass 435.093000 g/mol
InChI Key WIEYMFHXYNRELM-ZNWBIBPKSA-O
IUPAC 3-{[(2S,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium
InChI InChI=1S/C20H18O11/c21-6-15-17(27)18(28)20(31-15)30-14-5-9-10(23)3-8(22)4-13(9)29-19(14)7-1-11(24)16(26)12(25)2-7/h1-5,15,17-18,20-21,27-28H,6H2,(H4-,22,23,24,25,26)/p+1/t15-,17+,18-,20+/m0/s1
SMILES OC[C@@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@@H](O)[C@@H]1O
Food Berry
Food Source Blueberry
Family Phenolic
Class Flavonoid
Subclass Group Coumarin derivative
Subclass Anthocyanin
Metabolite Anthocyanin metabolite
CASNO 28500-01-8
HMDB HMDB0037998
PubChem 68245
KEGG C08604
FooDB FDB017192
DrugBank DB01904
ChEBI 28426
BioCyc CPD1F-766
METLIN 5221.0