Identification

PhytoHub ID
PHUB001356
Name
Dihydrodaidzein
Systematic Name
Not Available
Synonyms
  • 7,4'-dihydroxyisoflavanone
CAS Number
Not Available
Average Mass
256.257
Monoisotopic Mass
256.073558866
Chemical Formula
C15H12O4
IUPAC Name
(+/-)-dihydrodaidzein
InChI Key
JHYXBPPMXZIHKG-UHFFFAOYNA-N
InChI Identifier
InChI=1/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
SMILES
OC1=CC=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O
Structure

Calculated Properties

Solubility (ALOGPS)
1.35e-01 g/l
LogS (ALOGPS)
-3.28
LogP (ALOGPS)
2.77
Hydrogen Acceptors
4
Hydrogen Donors
2
Rotatable Bond Count
1
Polar Surface Area
66.76
Refractivity
69.69560000000001
Polarizability
25.76143011613891
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-4.906004166215412
pKa (strongest acidic)
7.775319556174
Number of Rings
3
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
Yes
Veber's Rule
No
MDDR-like Rule
No

Precursor Taxonomy

PrecursorFamilyClassSub-class
DaidzeinPolyphenolsFlavonoidsIsoflavonesShow Precursor

Spectra

No spectra information available

Food Sources

PrecursorFood SourceFood Source Group
DaidzeinSoy beanSoy and soy productsShow
DaidzeinSoy milkSoy and soy productsShow

Metabolism

PrecursorMetaboliteSpeciesBiofluidsOriginFormulaMonoisotopic mass
Daidzein Dihydrodaidzeinhumanurinehost metabolismC15H12O4256.073558866 Publications
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