ent-9-Hydroxy-15-oxokaur-16-en-19-oic acid β-D-glucopyranosyl ester

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For Research Use Only.

Size	Price	Stock	Quantity
5 mg	$1554	In stock

Category

Diterpenoids

Cat.No.

NP1235

CAS

81263-96-9

Product Name

ent-9-Hydroxy-15-oxokaur-16-en-19-oic acid β-D-glucopyranosyl ester

Structure

Product Details

Description

ent-9-Hydroxy-15-oxokaur-16-en-19-oic acid β-D-glucopyranosyl ester is a natural diterpenoid found in the herbs of Pteris semipinnata.

Synonyms

1-O-[(5β,8α,9β,10α,13α)-9-Hydroxy-15,18-dioxokaur-16-en-18-yl]-β- D-glucopyranose

IUPAC Name

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,4S,5R,9R,10R,13R)-10-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

Molecular Weight

494.6

Molecular Formula

C26H38O9

Canonical SMILES

CC1(CCCC2(C1CCC34C2(CCC(C3)C(=C)C4=O)O)C)C(=O)OC5C(C(C(C(O5)CO)O)O)O

InChI

InChI=1S/C26H38O9/c1-13-14-5-10-26(33)24(3)8-4-7-23(2,16(24)6-9-25(26,11-14)20(13)31)22(32)35-21-19(30)18(29)17(28)15(12-27)34-21/h14-19,21,27-30,33H,1,4-12H2,2-3H3/t14-,15-,16-,17-,18+,19-,21+,23-,24-,25+,26-/m1/s1

InChIKey

PKAGWWDWHSCPAS-TULSSYLPSA-N

Boiling Point

670.4±55.0 °C(Predicted)

Purity

>97%

Density

1.39±0.1 g/cm3(Predicted)

Appearance

Powder

Form

Powder

Packaging

5 mg

pKa

12.51±0.70(Predicted)

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