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3',4',5',7-Tetrahydroxyflavone

CAT: 0013-GTR19277858-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19277858-01Size:1 mg
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Description
3',4',5',7-Tetrahydroxyflavone is a high-purity biochemical reagent suitable for biochemical experiments and drug synthesis research.
CAS Number
67858-31-5
Smiles
OC1=CC=C2C (=O) C=C (OC2=C1) C1=CC (O) =C (O) C (O) =C1
Molecular Formula
C15H10O6
Molecular Weight
286.24
Notes
For research use only.

Chemical Information

7,3',4',5'-Tetrahydroxyflavone

7,3',4',5'-Tetrahydroxyflavone has been reported in Arabidopsis thaliana with data available.

CAS Number67858-31-5
PubChem CID5393164
IUPAC Name7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Molecular FormulaC15H10O6
Molecular Weight286.24
XLogP2.6
Topological Polar Surface Area107
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity435
SMILES
C1=CC2=C(C=C1O)OC(=CC2=O)C3=CC(=C(C(=C3)O)O)O
InChI
InChI=1S/C15H10O6/c16-8-1-2-9-10(17)6-13(21-14(9)5-8)7-3-11(18)15(20)12(19)4-7/h1-6,16,18-20H
InChIKey
CCCIGFPBADVTFE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7,3',4',5'-Tetrahydroxyflavone
CAS: 67858-31-5
CID: 5393164
Formula: C15H10O6
MW: 286.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.24
XLogP32.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass286.04773803
Monoisotopic Mass286.04773803
Topological Polar Surface Area107 Ų
Heavy Atom Count21
Formal Charge0
Complexity435
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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