Secondary Metabolites Search

RUGOSIN D

On this page

Structure

2D structure of RUGOSIN D
2D structure
Drag to rotate, scroll to zoom
3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 16129626

Names and identifiers

Name

RUGOSIN D

IUPAC name

(11aR,13S,14R,15S,15aR)-7-(6-((((11aR,13S,14R,15S,15aR)-2,3,4,5,6,7-hexahydroxy-9,17-dioxo-14,15-bis((3,4,5-trihydroxybenzoyl)oxy)-9,11,11a,13,14,15,15a,17-octahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecin-13-yl)oxy)carbonyl)-2,3,4-trihydroxyphenoxy)-2,3,4,5,6-pentahydroxy-9,17-dioxo-9,11,11a,13,14,15,15a,17-octahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecine-13,14,15-triyl tris(3,4,5-trihydroxybenzoate)

SMILES

C1[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3OC4=C(C(=C5C(=C4)C(=O)OC[C@@H]6[C@H]([C@@H]([C@H]([C@@H](O6)OC(=O)C7=CC(=C(C(=C7)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O)OC(=O)C9=CC(=C(C(=C9)O)O)O)OC(=O)C2=CC(=C(C(=C25)O)O)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O

General information

Molecular formula

C82H58O52

Molecular weight

1,875.31 g/mol

Monoisotopic mass

1,874.1894 Da

Classification

Pathway:
Shikimates and Phenylpropanoids
Superclass:
Phenolic acids (C6-C1)
Class:
Gallotannins
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Euphorbia prostrata Aiton - -
Chen, L., Chen, R.T., Wei, K.X. (1992). Constituents of tannins from Euphorbia prostrata Ait. Zhongguo Zhongyao Zazhi, 17(4), 225-226
Euphorbia prostrata Aiton leaf -
Yoshida, T., Namba, O., Chen, L., Liu, Y., Okuda, T. (1990). Ellagitannin monomers and oligomers from Euphorbia prostrata Ait. and oligomers from Loropetalum chinense Oliv. Chem Pharm Bull, 38(12), 3296-3302