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Alpinumisoflavone dimethyl ether

CAT: 1410-M39408Size: 1 EachDry Ice: NoHazardous: No
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Description
Alpinumisoflavone dimethyl ether
CAS Number
34086-56-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
———
Molecular Formula
———
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Alpinumisoflavone dimethyl ether

Alpinumisoflavone dimethyl ether is a member of isoflavanones.

CAS Number34086-56-1
PubChem CID10384155
IUPAC Name5-methoxy-7-(4-methoxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-6-one
Molecular FormulaC22H20O5
Molecular Weight364.4
XLogP4
Topological Polar Surface Area54
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity629
SMILES
CC1(C=CC2=C(O1)C=C3C(=C2OC)C(=O)C(=CO3)C4=CC=C(C=C4)OC)C
InChI
InChI=1S/C22H20O5/c1-22(2)10-9-15-17(27-22)11-18-19(21(15)25-4)20(23)16(12-26-18)13-5-7-14(24-3)8-6-13/h5-12H,1-4H3
InChIKey
WRINUBCCCQLTPU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alpinumisoflavone dimethyl ether
CAS: 34086-56-1
CID: 10384155
Formula: C22H20O5
MW: 364.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.4
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass364.13107373
Monoisotopic Mass364.13107373
Topological Polar Surface Area54 Ų
Heavy Atom Count27
Formal Charge0
Complexity629
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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