PRUNASIN

Structure

2D structure of PRUNASIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 119033

Names and identifiers

Name

PRUNASIN

IUPAC name

(R)-2-phenyl-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)acetonitrile

SMILES

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

General information

Molecular formula

C14H17NO6

Molecular weight

295.29 g/mol

Monoisotopic mass

295.1056 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Achillea millefolium L. subsp. millefolium - -
Bisset, N.G., ed. 1994. Herbal Drugs and Phytopharmaceuticals. CRC Press. Boca Raton, FL. 566 pp.
Prunus persica (L.) Batsch seed -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Pteridium aquilinum (L.) Kuhn subsp. aquilinum leaf 1580 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vicia sativa L. seed -
Ressler, C., Tatake, J.G. (2001). Vicianin, prunasin, and beta-cyanoalanine in common vetch seed as sources of urinary thiocyanate in the rat. J Agr Food Chem, 49(10), 5075-5080 doi:10.1021/jf010343w
Vicia segetalis Thuill. seed -
Ressler, C., Tatake, J.G. (2001). Vicianin, prunasin, and beta-cyanoalanine in common vetch seed as sources of urinary thiocyanate in the rat. J Agr Food Chem, 49(10), 5075-5080 doi:10.1021/jf010343w