Phloracetophenone 4'-O-glucoside

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For Research Use Only.

Category

Phenols

Cat.No.

NP4662

CAS

5027-30-5

Product Name

Phloracetophenone 4'-O-glucoside

Structure

Description

Phloracetophenone 4'-O-glucoside isolated from the barks of Acacia farnesiana.

Synonyms

Phloroacetophenone 4-O-beta-D-glucopyranoside

IUPAC Name

1-[2,6-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone

Molecular Weight

330.3

Molecular Formula

C14H18O9

Canonical SMILES

CC(=O)C1=C(C=C(C=C1O)OC2C(C(C(C(O2)CO)O)O)O)O

InChI

InChI=1S/C14H18O9/c1-5(16)10-7(17)2-6(3-8(10)18)22-14-13(21)12(20)11(19)9(4-15)23-14/h2-3,9,11-15,17-21H,4H2,1H3/t9-,11-,12+,13-,14-/m1/s1

InChIKey

ARYSAKCPIBLSDO-RGCYKPLRSA-N

Boiling Point

647.0±55.0 °C(Predicted)

Melting Point

228-229 °C

Purity

> 98%

Density

1.611±0.06 g/cm3(Predicted)

Appearance

Powder

pKa

9.13±0.15(Predicted)

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