Kaerophyllin

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For Research Use Only.
Category
Lignans
Cat.No.
NP3941
CAS
75590-33-9
Product Name
Kaerophyllin
Structure

Product Details

Description
Kaerophyllin isolated from the roots of Bupleurum chinense DC.
Synonyms
(3E,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one
IUPAC Name
(3E,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one
Molecular Weight
368.4
Molecular Formula
C21H20O6
Canonical SMILES
COC1=C(C=C(C=C1)C=C2C(COC2=O)CC3=CC4=C(C=C3)OCO4)OC
InChI
InChI=1S/C21H20O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,8-10,15H,7,11-12H2,1-2H3/b16-8+/t15-/m0/s1
InChIKey
CSKOHFAJPKLSBP-MDNIKOHYSA-N
Purity
> 95%
Appearance
Powder
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