Isosaxalin

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For Research Use Only.

Category

Coumarins

Cat.No.

NP1065

CAS

55481-86-2

Product Name

Isosaxalin

Structure

Description

Isosaxalin is from the roots of Angelica polymorpha Maxim.

Synonyms

9-{[(2R)-3-Chloro-2-hydroxy-3-methylbutyl]oxy}-7H-furo[3,2-g]chro men-7-one

IUPAC Name

9-(3-chloro-2-hydroxy-3-methylbutoxy)furo[3,2-g]chromen-7-one

Molecular Weight

322.7

Molecular Formula

C16H15ClO5

Canonical SMILES

CC(C)(C(COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)Cl

InChI

InChI=1S/C16H15ClO5/c1-16(2,17)11(18)8-21-15-13-10(5-6-20-13)7-9-3-4-12(19)22-14(9)15/h3-7,11,18H,8H2,1-2H3

InChIKey

VNNTVHKCIBWHDR-UHFFFAOYSA-N

Purity

> 95%

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