1-O-Caffeoylglucose

Name: 1-O-Caffeoylglucose
Brand: BOC Sciences
Rating: 5 (1 reviews)

Inquiry

For Research Use Only.

Category

Phenylpropanoids

Cat.No.

NP5508

CAS

14364-08-0

Product Name

1-O-Caffeoylglucose

Structure

Description

1-caffeoyl-beta-D-glucose is a cinnamate ester that has been reported in Ligustrum obtusifolium, Adenocaulon himalaicum, and other organisms.

Synonyms

1-Caffeoyl-beta-D-glucose; 1-O-caffeoyl-beta-D-glucose; 1-caffeoyl-β-D-glucose; β-D-Glucopyranose, 1-[3-(3,4-dihydroxyphenyl)-2-propenoate]

IUPAC Name

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Molecular Weight

342.30

Molecular Formula

C15H18O9

Canonical SMILES

C1=CC(=C(C=C1/C=C/C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O

InChI

InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1

InChIKey

WQSDYZZEIBAPIN-VBQORRLJSA-N

Boiling Point

644.7 °C at 760mmHg

Purity

98%

Density

1.64 g/cm3

Form

Powder

Packaging

5 mg

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