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Baicalein 6-O-glucoside

CAT: 1410-M39080-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Baicalein 6-O-glucoside is a natural product from Thymus serpyllum L.
CAS Number
28279-72-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
432.38
Molecular Formula
C21H20O10
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Baicalein 6-O-beta-D-glucopyranoside

tetuin has been reported in Cephalocereus senilis with data available.

CAS Number28279-72-3
PubChem CID5321896
IUPAC Name5,7-dihydroxy-2-phenyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC21H20O10
Molecular Weight432.4
XLogP0.9
Topological Polar Surface Area166
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity677
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
InChI
InChI=1S/C21H20O10/c22-8-14-16(25)18(27)19(28)21(30-14)31-20-11(24)7-13-15(17(20)26)10(23)6-12(29-13)9-4-2-1-3-5-9/h1-7,14,16,18-19,21-22,24-28H,8H2/t14-,16-,18+,19-,21+/m1/s1
InChIKey
WTYYPLMAODUDGW-QOUKUZOOSA-N
Chemical Structure
2D Structure
2D structure of Baicalein 6-O-beta-D-glucopyranoside
CAS: 28279-72-3
CID: 5321896
Formula: C21H20O10
MW: 432.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.4
XLogP30.9
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass432.10564683
Monoisotopic Mass432.10564683
Topological Polar Surface Area166 Ų
Heavy Atom Count31
Formal Charge0
Complexity677
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
AB3513Baicalein 6-O-glucoside
300731Oroxin A (Baicalein-7-O-glucoside, Baikalin)
OR1063669BAicalein 6-O-ß-D-glucopyranoside
300732Oroxin B (Baicalein-7-O-diglucoside, Baicalein-7-O-gentiobioside)
HY-N8788-01Baicalein 7-O-β-D-ethylglucuronide
TN3480-01Baicalein 7-O-beta-D-ethylglucuronide
MBS6095915-01Baicalein, Monohydrate (5,6,7-Trihydroxyflavone)
MBS1483024-01Recombinant Scutellaria baicalensis Baicalein 7-O-glucuronosyltransferase (UBGAT-I)
379518Agrimonolide 6-O-glucoside
GTR19179837Demethylagrimonolide 6-O-glucoside

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