APIGENIN-7-O-BETA-D-DIGLUCOSIDE

Structure

2D structure of APIGENIN-7-O-BETA-D-DIGLUCOSIDE
2D structure
Drag to rotate, scroll to zoom
3D model

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

Names and identifiers

Name

APIGENIN-7-O-BETA-D-DIGLUCOSIDE

IUPAC name

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

SMILES

C1=CC(=CC=C1C3=CC(=O)C2=C(C=C(C=C2O3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC5C(C(C(C(CO)O5)O)O)O)O)O)O)O)O

General information

Molecular formula

C27H30O15

Molecular weight

594.52 g/mol

Monoisotopic mass

594.1585 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Cirsium vulgare (Savi) Ten. subsp. vulgare leaf -
Mcgowan, S.G., Wallace, J.W. (1972). Flavonoids and phenolic acids from Cirsium lanceolatum. Phytochemistry, 11, 1503-1504 doi:10.1016/s0031-9422(00)90119-5
Lathyrus pratensis L. subsp. pratensis flower -
Reynaud, J., Blaise, S., Jay, M., Cartier, D. (1982). Response of flavonoid metabolism to environmental selection pressure in diverse populations of Lathyrus pratensis L. Taxon, 31, 684-690