RUGOSIN F

Structure

2D structure of RUGOSIN F
2D structure
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3D model

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

Names and identifiers

Name

RUGOSIN F

IUPAC name

(11aR,13S,14R,15S,15aR)-2,3,4,5,6,7-hexahydroxy-9,17-dioxo-13-((3,4,5-trihydroxy-2-((1,2,3,14,15,16,17,18,25,26,27-undecahydroxy-5,11,20,23-tetraoxo-7-((3,4,5-trihydroxybenzoyl)oxy)-5,6a,7,8a,9,11,20,21a,21b,23-decahydrodibenzo[g,i]dibenzo[6',7':8',9'][1,4]dioxecino[2',3':4,5]pyrano[3,2-b][1,5]dioxacycloundecin-13-yl)oxy)benzoyl)oxy)-9,11,11a,13,14,15,15a,17-octahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecine-14,15-diyl bis(3,4,5-trihydroxybenzoate)

SMILES

C3C%11C(OC(=O)C1=CC(=C(C(=C1C2=C(C(=C(C=C2C(=O)O3)OC4=C(C(=C(C=C4C(=O)O[C@H]5[C@@H]([C@H]([C@H]8[C@H](O5)COC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O8)O)O)O)O)O)O)OC(=O)C9=CC(=C(C(=C9)O)O)O)OC(=O)C%10=CC(=C(C(=C%10)O)O)O)O)O)O)O)O)O)O)O)C%13C(C(O%11)OC(C%12=CC(=C(C(=C%12)O)O)O)=O)OC(C%15=C(C%14=C(C(O%13)=O)C=C(C(=C%14O)O)O)C(=C(C(=C%15)O)O)O)=O

General information

Molecular formula

C82H56O52

Molecular weight

1,873.30 g/mol

Monoisotopic mass

1,872.1738 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Euphorbia prostrata Aiton leaf -
Yoshida, T., Namba, O., Kurokawa, K., Amakura, Y., Liu, Y.Z., Okuda, T. (1994). Tannins and related polyphenols of Euphorbiaceous plants. xii. euphorbins g and h, new dimeric hydrolyzable tannins from Euphorbia prostrata and Euphorbia makinoi. Chem Pharm Bull, 42(10), 2005-2010 doi:10.1248/cpb.42.2005