Blumenol C glucoside

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For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5601

CAS

135820-80-3

Product Name

Blumenol C glucoside

Structure

Product Details

Description

Blumenol C glucoside isolated from the barks of Pseudolarix amabilis.

Synonyms

(2S)-4-[(1R)-2,6,6-Trimethyl-4-oxo-2-cyclohexen-1-yl]-2-butanyl β -D-glucopyranoside

IUPAC Name

(4R)-3,5,5-trimethyl-4-[(3R)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]cyclohex-2-en-1-one

Molecular Weight

372.5

Molecular Formula

C19H32O7

Canonical SMILES

CC1=CC(=O)CC(C1CCC(C)OC2C(C(C(C(O2)CO)O)O)O)(C)C

InChI

InChI=1S/C19H32O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h7,11,13-18,20,22-24H,5-6,8-9H2,1-4H3/t11-,13+,14-,15-,16+,17-,18-/m1/s1

InChIKey

NYLNHNDMNOPWAZ-ZLEFDVGRSA-N

Boiling Point

547.8±50.0 °C(Predicted)

Purity

0.93

Density

1.24±0.1 g/cm3(Predicted)

Appearance

Oil

pKa

12.92±0.70(Predicted)

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