Identification

PhytoHub ID
PHUB000870
Name
Chrysin
Synonyms
  • 5,7-Dihydroxyflavone
CAS Number
Not Available
Average Mass
254.2375
Monoisotopic Mass
254.057908808
Chemical Formula
C15H10O4
IUPAC Name
chrysin
InChI Key
RTIXKCRFFJGDFG-UHFFFAOYSA-N
InChI Identifier
InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H
SMILES
OC1=CC(O)=C2C(=O)C=C(OC2=C1)C1=CC=CC=C1
Structure

Calculated Properties

Solubility (ALOGPS)
1.05e-01 g/l
LogS (ALOGPS)
-3.38
LogP (ALOGPS)
3.44
Hydrogen Acceptors
4
Hydrogen Donors
2
Rotatable Bond Count
1
Polar Surface Area
66.76
Refractivity
70.933
Polarizability
25.72774514973364
Formal Charge
0
Physiological Charge
-1
pKa (strongest basic)
-5.174527093098605
pKa (strongest acidic)
6.637868205362397
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Taxonomy

Family
Polyphenols
Class
Flavonoids
Sub-class
Flavones

Spectra

Record IDSourceDescriptionView
BML01054MassBankLC-ESI-QTOF Spectrum - 10 ev, unspecifiedView Spectra
BML01057MassBankLC-ESI-QTOF Spectrum - 20 ev, unspecifiedView Spectra
BML01060MassBankLC-ESI-QTOF Spectrum - 40 ev, unspecifiedView Spectra
BML01063MassBankLC-ESI-QTOF Spectrum - 10 ev, unspecifiedView Spectra
BML01066MassBankLC-ESI-QTOF Spectrum - 20 ev, unspecifiedView Spectra
BML01069MassBankLC-ESI-QTOF Spectrum - 40 ev, unspecifiedView Spectra
BML80935MassBankLC-ESI-QTOF Spectrum - -, unspecifiedView Spectra
BML80936MassBankLC-ESI-QTOF Spectrum - -, unspecifiedView Spectra
FIO00023MassBankLC-ESI-QTOF Spectrum - 10 eV, unspecifiedView Spectra
FIO00024MassBankLC-ESI-QTOF Spectrum - 20 eV, unspecifiedView Spectra
FIO00025MassBankLC-ESI-QTOF Spectrum - 30 eV, unspecifiedView Spectra
FIO00026MassBankLC-ESI-QTOF Spectrum - 40 eV, unspecifiedView Spectra
FIO00027MassBankLC-ESI-QTOF Spectrum - 50 eV, unspecifiedView Spectra
FIO00028MassBankLC-ESI-QTOF Spectrum - 10 eV, unspecifiedView Spectra
FIO00029MassBankLC-ESI-QTOF Spectrum - 20 eV, unspecifiedView Spectra
FIO00030MassBankLC-ESI-QTOF Spectrum - 30 eV, unspecifiedView Spectra
FIO00031MassBankLC-ESI-QTOF Spectrum - 40 eV, unspecifiedView Spectra
FIO00032MassBankLC-ESI-QTOF Spectrum - 50 eV, unspecifiedView Spectra

Food Sources

No food source information available

Metabolism

No metabolism information available

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