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Kaempferol-4-glucoside

CAT: 1410-M23115-01Size: 1 EachDry Ice: NoHazardous: No
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Description
It is a kind of Flavonoids compounds
CAS Number
52222-74-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
448.38
Molecular Formula
C21H20O11
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Kaempferol 4'-O-glucoside

Kaempferol 4'-O-beta-D-glucopyranoside is a kaempferol O-glucoside that is kaempferol attached to a beta-D-glucopyranosyl moiety at position 4' via a glycosidic linkage. It has a role as a plant metabolite. It is a beta-D-glucoside, a trihydroxyflavone, a member of flavonols, a monosaccharide derivative and a kaempferol O-glucoside.

CAS Number52222-74-9
PubChem CID5491693
IUPAC Name3,5,7-trihydroxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Molecular FormulaC21H20O11
Molecular Weight448.4
XLogP0.1
Topological Polar Surface Area186
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity719
SMILES
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI
InChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)30-10-3-1-8(2-4-10)20-18(28)16(26)14-11(24)5-9(23)6-12(14)31-20/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1
InChIKey
AUCGRWHWAGXNQS-HMGRVEAOSA-N
Chemical Structure
2D Structure
2D structure of Kaempferol 4'-O-glucoside
CAS: 52222-74-9
CID: 5491693
Formula: C21H20O11
MW: 448.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.4
XLogP30.1
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass448.10056145
Monoisotopic Mass448.10056145
Topological Polar Surface Area186 Ų
Heavy Atom Count32
Formal Charge0
Complexity719
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR19156646-01Kaempferol-4-glucoside
TBZ2405Kaempferol-4'-glucoside
HY-N2054Kaempferol 4'-glucoside
300526Kaempferol-4'-glucoside discontinued
TRC-K346210-50MGKaempferol 4′-O-glucoside
PDA43958-01Kaempferol 3-rutinoside 4′-glucoside
sc-286033CKaempferol-3-glucoside
GL9890-10mgKaempferol 3-glucoside
GTR19237058-01Kaempferol 3,4-di-O-glucoside
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