ARBUTIN

Structure

2D structure of ARBUTIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 440936

Names and identifiers

Name

ARBUTIN

IUPAC name

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)tetrahydro-2H-pyran-3,4,5-triol

SMILES

C1=CC(=CC=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

General information

Molecular formula

C12H16O7

Molecular weight

272.25 g/mol

Monoisotopic mass

272.0896 Da

Classification

Pathway:
Superclass:
-
Class:
-
Glycoside:
Yes

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Galium album Mill. - -
Bock, K., Jensen, S.R., Nielsen, B.J. (1976). Secogalioside, an iridoid glucoside from Galium album and c-13 nmr spectra of some seco-iridoid glucosides. Acta Chem Scand Ser B, 30, 743 doi:10.3891/acta.chem.scand.30b-0743
Pyrus communis L. subsp. pyraster (L.) Ehrh. - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vaccinium myrtillus L. - 15000 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vaccinium myrtillus L. fruit -
Williamson, E. M. and Evans, F. J., Potter's New Cyclopaedia of Botanical Drugs and Preparations, Revised Ed., Saffron Walden, the C. W. Daniel Co., Ltd., Essex UK, 362 pp, 1988, reprint 1989.
Vaccinium myrtillus L. leaf 3000 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.