APIGENIN-7-O-(4-COUMAROYL-GLUCOSIDE)

Structure

2D structure of APIGENIN-7-O-(4-COUMAROYL-GLUCOSIDE)
2D structure
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3D model

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

Names and identifiers

Name

APIGENIN-7-O-(4-COUMAROYL-GLUCOSIDE)

IUPAC name

(2R,3S,4R,5S,6S)-3,5-dihydroxy-2-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl (E)-3-(4-hydroxyphenyl)acrylate

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)CO)O)OC(\C(=C(\C5=CC=C(C=C5)O)[H])[H])=O)O)O)O

General information

Molecular formula

C30H26O12

Molecular weight

578.53 g/mol

Monoisotopic mass

578.1424 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

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