Bullatantriol

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For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5538

CAS

99933-32-1

Product Name

Bullatantriol

Structure

Description

Bullatantriol is a natural sesquiterpenoid isolated from the rhizoma of Acorus calamus.

Synonyms

(3R,3aR,4S,7R,7aR)-3-(2-hydroxy-2-methylpropyl)-4,7a-dimethyl-2,3,3a,5,6,7-hexahydro-1H-indene-4,7-diol

IUPAC Name

(3R,3aR,4S,7R,7aR)-3-(2-hydroxy-2-methylpropyl)-4,7a-dimethyl-2,3,3a,5,6,7-hexahydro-1H-indene-4,7-diol

Molecular Weight

256.4

Molecular Formula

C15H28O3

Canonical SMILES

CC12CCC(C1C(CCC2O)(C)O)CC(C)(C)O

InChI

InChI=1S/C15H28O3/c1-13(2,17)9-10-5-7-14(3)11(16)6-8-15(4,18)12(10)14/h10-12,16-18H,5-9H2,1-4H3/t10-,11-,12-,14+,15+/m1/s1

InChIKey

JQHTXZNYHSCIFE-FPVZYODXSA-N

Purity

>98%

Appearance

Cryst.

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