precursor

Showing entry for Taxifolin

Identification

PhytoHub ID
PHUB001756
Name
Taxifolin
Systematic Name
Not Available
Synonyms
  • Dihydroquercetin
  • trans-Dihydroquercetin
CAS Number
480-18-2
Average Mass
304.254
Monoisotopic Mass
304.058302726
Chemical Formula
C15H12O7
IUPAC Name
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one
InChI Key
CXQWRCVTCMQVQX-LSDHHAIUSA-N
InChI Identifier
InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H/t14-,15+/m0/s1
SMILES
O[C@@H]1[C@H](OC2=CC(O)=CC(O)=C2C1=O)C1=CC(O)=C(O)C=C1
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
1.16e+00 g/l
LogS (ALOGPS)
-2.42
LogP (ALOGPS)
1.07
Hydrogen Acceptors
7
Hydrogen Donors
5
Rotatable Bond Count
1
Polar Surface Area
127.45000000000002
Refractivity
74.6089
Polarizability
28.972364217473427
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-4.040608005010741
pKa (strongest acidic)
7.742827034290162
Number of Rings
3
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
Yes
Veber's Rule
No
MDDR-like Rule
No

Taxonomy as Food Phytochemical

Family
Polyphenols
Class
Flavonoids
Sub-class
Flavan-3-ols

Spectra from Online Resources

No spectra information available

Food Sources

NameGroup
StrawberryFruit, Berries PublicationsShow

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

No metabolism information available

Inter-Individual Variations in Metabolism

No data on inter-individual variations available

Back