PRUNITRIN

Structure

2D structure of PRUNITRIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 12314655

Names and identifiers

Name

PRUNITRIN

IUPAC name

5-hydroxy-7-methoxy-3-(4-(((3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-4H-chromen-4-one

SMILES

O=C1C(C2=CC=C(OC3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O)C=C2)=COC4=C1C(O)=CC(OC)=C4

General information

Molecular formula

C22H22O10

Molecular weight

446.41 g/mol

Monoisotopic mass

446.1213 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Trifolium pratense L. subsp. pratense aerial parts -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.