Pterosin D 3-O-glucoside

Inquiry

For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5754

CAS

84299-80-9

Product Name

Pterosin D 3-O-glucoside

Structure

Product Details

Description

Pterosin D 3-O-glucoside is a natural sesquiterpenoid found in the rhizoma of Cibotium barometz (L.) J.Sm.

Synonyms

(R)-3-(beta-D-Glucopyranosyloxy)-2,3-dihydro-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-1H-inden-1-one

IUPAC Name

(3R)-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3H-inden-1-one

Molecular Weight

410.46

Molecular Formula

C21H30O8

Canonical SMILES

CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2OC3C(C(C(C(O3)CO)O)O)O)(C)C

InChI

InChI=1S/C21H30O8/c1-9-7-12-14(10(2)11(9)5-6-22)18(27)21(3,4)19(12)29-20-17(26)16(25)15(24)13(8-23)28-20/h7,13,15-17,19-20,22-26H,5-6,8H2,1-4H3/t13-,15-,16+,17-,19-,20+/m1/s1

InChIKey

WGTDJCXEVHBDAH-UMYDBDEDSA-N

Boiling Point

653.0±55.0 °C(Predicted)

Purity

>96%

Density

1.38±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

12.84±0.70(Predicted)

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