ISORHAMNETIN 3,7-BETA-D-DIGLUCOSIDE

Structure

2D structure of ISORHAMNETIN 3,7-BETA-D-DIGLUCOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44259357

Names and identifiers

Name

ISORHAMNETIN 3,7-BETA-D-DIGLUCOSIDE

IUPAC name

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

SMILES

COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O[C@H]4C([C@H]([C@@H](C(O4)CO)O)O)O)O)O[C@@H]5C(C([C@@H](C(O5)CO)O)O)O)O

General information

Molecular formula

C28H32O17

Molecular weight

640.55 g/mol

Monoisotopic mass

640.1640 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Mutarda arvensis (L.) D.A.German leaf -
Durkee, A.B., Harrbone, J.B. (1973). Flavonol glycosides in Brassica and Sinapis. Phytochemistry, 12, 1085-1089 doi:10.1016/0031-9422(73)85020-4
Taraxacum F.H.Wigg. sect. Taraxacum flower -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.