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3'-Hydroxypuerarin

CAT: 0013-GTR19170847-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170847-02Size:5 mg
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Description
3'-Hydroxypuerarin is an isoflavone antioxidant isolated from the roots of Pueraria lobata. It exhibits potent scavenging activity against peroxynitrite (ONOO−), nitric oxide (NO−), and total reactive oxygen species (ROS) . This compound is widely used in research on oxidative stress, inflammation, and neuroprotection in both cellular and animal models.
CAS Number
117060-54-5
Product Name Alternative
Pueraria glycoside, Reactive Oxygen Species, antioxidant, 3' Hydroxypuerarin, 3'Hydroxypuerarin, 3'-Hydroxypuerarin, 3'-hydroxy Puerarin, inhibit, Inhibitor
Field of Research
Immunology & Inflammation, Metabolism Research, Signal Transduction
Purity
98.55% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.63 mM) ; DMSO:55 mg/mL (127.2 mM)
Smiles
OC[C@H]1O[C@H] ([C@H] (O) [C@@H] (O) [C@@H]1O) c1c (O) ccc2c1occ (-c1ccc (O) c (O) c1) c2=O
Molecular Formula
C21H20O10
Molecular Weight
432.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3'-Hydroxypuerarin

3'-Hydroxypuerarin has been reported in Pueraria montana var. lobata with data available.

CAS Number117060-54-5
PubChem CID5748205
IUPAC Name3-(3,4-dihydroxyphenyl)-7-hydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Molecular FormulaC21H20O10
Molecular Weight432.4
XLogP-0.3
Topological Polar Surface Area177
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity698
SMILES
C1=CC(=C(C=C1C2=COC3=C(C2=O)C=CC(=C3[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O
InChI
InChI=1S/C21H20O10/c22-6-14-17(27)18(28)19(29)21(31-14)15-12(24)4-2-9-16(26)10(7-30-20(9)15)8-1-3-11(23)13(25)5-8/h1-5,7,14,17-19,21-25,27-29H,6H2/t14-,17-,18+,19-,21+/m1/s1
InChIKey
GARZMRVWLORUSR-VPRICQMDSA-N
Chemical Structure
2D Structure
2D structure of 3'-Hydroxypuerarin
CAS: 117060-54-5
CID: 5748205
Formula: C21H20O10
MW: 432.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.4
XLogP3-0.3
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Exact Mass432.10564683
Monoisotopic Mass432.10564683
Topological Polar Surface Area177 Ų
Heavy Atom Count31
Formal Charge0
Complexity698
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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