Aculeatin

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For Research Use Only.

Category

Coumarins

Cat.No.

NP1018

CAS

77636-05-6

Product Name

Aculeatin

Structure

Description

Aculeatin is a natural product found in Zanthoxylum asiaticum.

Synonyms

5,7-Dimethoxy-6-(3,3-dimethyloxirane-2-ylmethyl)-2H-1-benzopyran-2-one

IUPAC Name

6-[(3,3-dimethyloxiran-2-yl)methyl]-5,7-dimethoxychromen-2-one

Molecular Weight

290.31

Molecular Formula

C16H18O5

Canonical SMILES

CC1(C(O1)CC2=C(C=C3C(=C2OC)C=CC(=O)O3)OC)C

InChI

InChI=1S/C16H18O5/c1-16(2)13(21-16)7-10-11(18-3)8-12-9(15(10)19-4)5-6-14(17)20-12/h5-6,8,13H,7H2,1-4H3

InChIKey

DZSSBQWTSOMKDI-UHFFFAOYSA-N

Purity

98%

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