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Oxyimperatorin

CAT: 1410-M22817-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M22817-02Size:1 mL x 10 mM in DMSO
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Description
Oxyimperatorin is a natural product from Angelica dahurica.
CAS Number
35740-18-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
286.28
Molecular Formula
C16H14O5
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Oxyimperatorin

prangenin has been reported in Ferula sumbul, Ferula moschata, and Angelica dahurica with data available.

CAS Number35740-18-2
PubChem CID182251
IUPAC Name9-[(3,3-dimethyloxiran-2-yl)methoxy]furo[3,2-g]chromen-7-one
Molecular FormulaC16H14O5
Molecular Weight286.28
XLogP2.2
Topological Polar Surface Area61.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity471
SMILES
CC1(C(O1)COC2=C3C(=CC4=C2OC=C4)C=CC(=O)O3)C
InChI
InChI=1S/C16H14O5/c1-16(2)11(21-16)8-19-15-13-10(5-6-18-13)7-9-3-4-12(17)20-14(9)15/h3-7,11H,8H2,1-2H3
InChIKey
CTJZWFCPUDPLME-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxyimperatorin
CAS: 35740-18-2
CID: 182251
Formula: C16H14O5
MW: 286.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.28
XLogP32.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass286.08412354
Monoisotopic Mass286.08412354
Topological Polar Surface Area61.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity471
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N4273-01Oxyimperatorin
HY-N4273ROxyimperatorin (Standard)

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