PODOPHYLLOTOXIN GLUCOSIDE

Structure

2D structure of PODOPHYLLOTOXIN GLUCOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 161177

Names and identifiers

Name

PODOPHYLLOTOXIN GLUCOSIDE

IUPAC name

(5R,5aR,8aR,9R)-9-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

SMILES

COC1=C(C(=CC(=C1)[C@@H]4C2=C(C=C3C(=C2)OCO3)[C@@H]([C@@H]5[C@@H]4C(=O)OC5)O[C@H]6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)O)O)O)OC)OC

General information

Molecular formula

C28H32O13

Molecular weight

576.55 g/mol

Monoisotopic mass

576.1843 Da

Classification

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

Plants with the compound

Plant Plant part Amount Reference
Linum catharticum L. subsp. catharticum leaf -
Belma, K. (1998). Arytetralin lignans from Linum catharticum L. Biochem Syst Ecol, 26(7), 795-796 doi:10.1016/s0305-1978(98)00045-3
Linum catharticum L. subsp. catharticum root -
Belma, K. (1998). Arytetralin lignans from Linum catharticum L. Biochem Syst Ecol, 26(7), 795-796 doi:10.1016/s0305-1978(98)00045-3