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Dihydrodaidzein

CAT: 0024-sc-207580Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-207580Size:50 mg
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CAS Number
17238-05-0

Chemical Information

(+-)-Dihydrodaidzein

Dihydrodaidzein is a hydroxyisoflavanone that is isoflavanone carrying two hydroxy substituents located at positions 4' and 7. It has a role as a metabolite.

CAS Number17238-05-0
PubChem CID176907
IUPAC Name7-hydroxy-3-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Molecular FormulaC15H12O4
Molecular Weight256.25
XLogP2.4
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity335
SMILES
C1C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)O
InChI
InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-7,13,16-17H,8H2
InChIKey
JHYXBPPMXZIHKG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (+-)-Dihydrodaidzein
CAS: 17238-05-0
CID: 176907
Formula: C15H12O4
MW: 256.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.25
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass256.07355886
Monoisotopic Mass256.07355886
Topological Polar Surface Area66.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity335
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C4020-25Dihydrodaidzein
MBS6095274-01Dihydrodaidzein ((R,S)-2,3-Dihydrodaidzein)
T12796-01S-Dihydrodaidzein
D3570-40ADihydrodaidzein ((R, S) -2,3-Dihydrodaidzein) discontinued
HY-N1461RDihydrodaidzein (Standard)
FD65355Dihydrodaidzein-7,4'-dimethylether

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