TORMENTOSIDE

Structure

2D structure of TORMENTOSIDE
2D structure
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3D model

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

Names and identifiers

Name

TORMENTOSIDE

IUPAC name

(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (1R,2R,4aS,6aS,6bR,10R,11R,12aR)-1,10,11-trihydroxy-1,2,6a,6b,9,9,10,12a-octamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate

SMILES

C1[C@]2(C(C([C@@]([C@@H]1O)(C)O)(C)C)CC[C@@]3(C2CC=C4[C@]3(CC[C@@]5(C4[C@]([C@@H](CC5)C)(C)O)C(=O)O[C@@H]6[C@H]([C@@H]([C@H]([C@H](CO)O6)O)O)O)C)C)C

General information

Molecular formula

C37H60O10

Molecular weight

664.88 g/mol

Monoisotopic mass

664.4186 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Potentilla erecta (L.) Raeusch. rhizome -
Stachurski, L., Strzelecka, H. (1994). Quantitative determination of tormentoside and two of its isomers in Potentilla erecta L. rhizomes. Herba Pol, 40(3), 99-105