ISORHAMNETIN-3-4’-7-O-BETA-D-TRIGLUCOSIDE

Structure

2D structure of ISORHAMNETIN-3-4’-7-O-BETA-D-TRIGLUCOSIDE
2D structure
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3D model

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

Names and identifiers

Name

ISORHAMNETIN-3-4’-7-O-BETA-D-TRIGLUCOSIDE

IUPAC name

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

SMILES

COC1=C(C=CC(=C1)C3=C(C(=O)C2=C(C=C(C=C2O3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O[C@@H]5[C@H]([C@@H](C([H])([C@@H](O5)CO)O)O)O)O[C@@H]6[C@H]([C@@H]([C@H]([C@@H](O6)O)O)O)CO

General information

Molecular formula

C34H42O22

Molecular weight

802.69 g/mol

Monoisotopic mass

802.2168 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Diplotaxis tenuifolia (L.) DC. flower -
Pacheco, H. (1958). Biochemical comparison of pigments in flowers of Cruciferae. V. structure of glucoside a from Diplotaxis tenuifolia flowers. Bull Soc Chim Biol, 40, 511-517