ISORHAMNETIN-3-GLUCOSIDE-4’-RHAMNOSIDE

Structure

2D structure of ISORHAMNETIN-3-GLUCOSIDE-4’-RHAMNOSIDE
2D structure
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3D model

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

Names and identifiers

Name

ISORHAMNETIN-3-GLUCOSIDE-4’-RHAMNOSIDE

IUPAC name

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

SMILES

C[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)OC2=C(C=C(C=C2)C4=C(C(=O)C3=C(C=C(C=C3O4)O)O)O[C@@H]5[C@H]([C@@H]([C@H]([C@@H](O5)CO)O)O)O)OC)O)O)O

General information

Molecular formula

C28H32O16

Molecular weight

624.55 g/mol

Monoisotopic mass

624.1690 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

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