Products 14364-08-0
CAS 14364-08-0 is the registry number for 1-O-Caffeoyl-β-D-glucopyranose. Offered by: Chemat, MedChemExpress. Available pack sizes: 2mg, 5 mg, 1 mg.
1-caffeoyl-beta-D-glucose is a cinnamate ester obtained by the formal condensation of the 1-hydroxy group of beta-D-glucopyranose with the carboxy group of trans-caffeic acid. It has a role as a plant metabolite. It is a beta-D-glucoside, a member of catechols, a cinnamate ester and a monosaccharide derivative. It is functionally related to a trans-caffeic acid.
Source: ChEBI
| Molecular formula | C15H18O9 |
|---|---|
| Molecular weight | 342.30 g/mol |
| IUPAC name | [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| InChIKey | WQSDYZZEIBAPIN-VBQORRLJSA-N |
| 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 |
Computed by PubChem (NCBI)
Synonyms:
1-Caffeoyl-beta-D-glucose, 1-O-caffeoyl-beta-D-glucose, b-D-Glucopyranose, 1-[3-(3,4-dihydroxyphenyl)-2-propenoate], 1-O-Caffeoyl-|A-D-glucopyranose, 1-O-caffeoyl-beta-d-glucopyranose, 1-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranose, Caffeic acid hexoside, Caffeoyl glucoside, caffeic acid glucoside, caffeoyl hexoside