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7-Hydroxyisoflavone

CAT: 1410-M21220-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M21220-05Size:100 mg
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Description
7-Hydroxyisoflavone against Enterovirus 71 in vitro.
CAS Number
13057-72-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
238.24
Molecular Formula
C15H10O3
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

7-Hydroxyisoflavone

7-hydroxyisoflavone is the simplest member of the class of 7-hydroxyisoflavones that is isoflavone with a hydroxy substituent at position 7. It has a role as a metabolite and an EC 1.14.14.14 (aromatase) inhibitor. It is a conjugate acid of a 7-hydroxyisoflavone(1-).

CAS Number13057-72-2
PubChem CID5376891
IUPAC Name7-hydroxy-3-phenylchromen-4-one
Molecular FormulaC15H10O3
Molecular Weight238.24
XLogP2.8
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity355
SMILES
C1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O
InChI
InChI=1S/C15H10O3/c16-11-6-7-12-14(8-11)18-9-13(15(12)17)10-4-2-1-3-5-10/h1-9,16H
InChIKey
WMKOZARWBMFKAS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Hydroxyisoflavone
CAS: 13057-72-2
CID: 5376891
Formula: C15H10O3
MW: 238.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight238.24
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass238.062994177
Monoisotopic Mass238.062994177
Topological Polar Surface Area46.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity355
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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MBS57907163'-methoxy-5'-hydroxyisoflavone-7-O-beta-D-glucoside
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