KAEMPFEROL-3-O-Α-L-RHAMNOPYRANOSYL-(1→2)-[6-O-(3-HYDROXY-3-METHYLGLUTARYL)-Β-D-GALACTOPYRANOSIDE

Structure

2D structure of KAEMPFEROL-3-O-Α-L-RHAMNOPYRANOSYL-(1→2)-[6-O-(3-HYDROXY-3-METHYLGLUTARYL)-Β-D-GALACTOPYRANOSIDE
2D structure
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3D model

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

Names and identifiers

Name

KAEMPFEROL-3-O-Α-L-RHAMNOPYRANOSYL-(1→2)-[6-O-(3-HYDROXY-3-METHYLGLUTARYL)-Β-D-GALACTOPYRANOSIDE

IUPAC name

5-(((2R,3S,4S,5R,6S)-6-((5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl)oxy)-3,4-dihydroxy-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-3-hydroxy-3-methyl-5-oxopentanoic acid

SMILES

OC1=CC2=C(C(=C1)O)C(C(=C(O2)C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(CC(CC(=O)O)(C)O)=O)O)O)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)O)O)O)=O

General information

Molecular formula

C33H38O19

Molecular weight

738.65 g/mol

Monoisotopic mass

738.2007 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Astragalus monspessulanus L. subsp. monspessulanus - -
Chemical composition and antioxidant activity of Astragalus monspessulanus L. growing in semiarid areas of Algeria Flavoalkaloids and Flavonoids from Astragalus monspessulanus