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Kaempferol-3-glucoside

C21H20O11 448.4 g/mol
H O O O O O H H O O O H O H H O H O
Name Kaempferol-3-glucoside
Alternative name Astragalin
Formula C21H20O11
Formula Weight 448.40 g/mol
Molecular Weight 448.40 g/mol
Monoisotopic Mass 448.101000 g/mol
InChI Key JPUKWEQWGBDDQB-QSOFNFLRSA-N
IUPAC 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
InChI InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1
SMILES OC[C@H]1O[C@@H](OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
Food BerryGreen teaTea
Food Source StrawberryGreen teaBlack tea
Family Phenolic
Class Flavonoid
Subclass Group Flavonol derivative
Subclass Flavonol
Metabolite Flavonol metabolite
CASNO 480-10-4
HMDB HMDB0037429
PubChem 5282102
KEGG C12249
FooDB FDB016478
DrugBank DB01852
ChEBI 30200
BioCyc CPD1F-453
METLIN 3445.0