2,6,16-Kauranetriol 2-O-β-D-allopyranoside

Inquiry

For Research Use Only.

Category

Diterpenoids

Cat.No.

NP1750

CAS

195735-16-1

Product Name

2,6,16-Kauranetriol 2-O-β-D-allopyranoside

Structure

Product Details

Description

2,6,16-Kauranetriol 2-O-beta-D-allopyraside is a natural diterpenoid found in the herbs of Pteris cretica.

Synonyms

(2R,3R,4R,5S,6R)-2-(((2R,4aR,5R,6aR,8R,9R,11aR,11bS)-5,8-dihydroxy-4,4,8,11b-tetramethyltetradecahydro-6a,9-methanocyclohepta[a]naphthalen-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

IUPAC Name

(2R,3R,4R,5S,6R)-2-[[(1R,3R,4R,7R,9S,10R,13R,14R)-3,14-dihydroxy-5,5,9,14-tetramethyl-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Molecular Weight

484.6

Molecular Formula

C26H44O8

Canonical SMILES

CC1(CC(CC2(C1C(CC34C2CCC(C3)C(C4)(C)O)O)C)OC5C(C(C(C(O5)CO)O)O)O)C

InChI

InChI=1S/C26H44O8/c1-23(2)8-14(33-22-20(31)19(30)18(29)16(11-27)34-22)9-24(3)17-6-5-13-7-26(17,12-25(13,4)32)10-15(28)21(23)24/h13-22,27-32H,5-12H2,1-4H3/t13-,14-,15-,16-,17+,18-,19-,20-,21-,22-,24+,25-,26-/m1/s1

InChIKey

RGKNTHMUHXNDHJ-GMOWVNSKSA-N

Boiling Point

654.3±55.0 °C(Predicted)

Purity

>95%

Density

1.33±0.1 g/cm3(Predicted)

Appearance

Powder

Color

Yellow

Form

Powder

pKa

12.92±0.70(Predicted)

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