6α-Hydroxynidorellol

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For Research Use Only.

Category

Diterpenoids

Cat.No.

NP1719

CAS

70387-38-1

Product Name

6α-Hydroxynidorellol

Structure

Product Details

Description

6α-Hydroxynidorellol is a natural diterpenoid found in the herbs of Callicarpa macrophylla.

Synonyms

6alpha-Hydroxynidorellol

IUPAC Name

(1R,2S,3S,4R,4aS,8aS)-3,4a,8,8-tetramethyl-4-[(2E)-3-methylpenta-2,4-dienyl]-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,2,3-triol

Molecular Weight

322.49

Molecular Formula

C20H34O3

Canonical SMILES

CC(=CCC1C2(CCCC(C2C(C(C1(C)O)O)O)(C)C)C)C=C

InChI

InChI=1S/C20H34O3/c1-7-13(2)9-10-14-19(5)12-8-11-18(3,4)16(19)15(21)17(22)20(14,6)23/h7,9,14-17,21-23H,1,8,10-12H2,2-6H3/b13-9+/t14-,15-,16+,17+,19-,20+/m1/s1

InChIKey

JEZOMVOAWYLQAJ-SKDBMBEJSA-N

Boiling Point

408.5±30.0 °C(Predicted)

Purity

>95%

Density

1.030±0.06 g/cm3(Predicted)

Appearance

Powder

Color

Yellow

Form

Powder

pKa

14.27±0.70(Predicted)

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