SILENOSIDE C

Structure

2D structure of SILENOSIDE C
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 196245

Names and identifiers

Name

SILENOSIDE C

IUPAC name

(1S,2R,3R,5R,9R,10R,13R,17S)-17-((2R,3R)-2,6-dihydroxy-6-methyl-3-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)heptan-2-yl)-1,2,3,14-tetrahydroxy-10,13-dimethyl-1,2,3,4,5,9,10,11,12,13,14,15,16,17-tetradecahydro-6H-cyclopenta[a]phenanthren-6-one

SMILES

C[C@]12CC[C@H]3C(=CC(=O)[C@H]4[C@@]3([C@@H]([C@@H]([C@@H](C4)O)O)O)C)C1(CC[C@@H]2[C@](C)([C@@H](CCC(C)(C)O)O[C@@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)O)O

General information

Molecular formula

C33H54O13

Molecular weight

658.78 g/mol

Monoisotopic mass

658.3564 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Silene vulgaris (Moench) Garcke subsp. vulgaris root -
Glensk, M., Wray, V., Nimtz, M., Schopke, T. (1999). Silenosides a-c, triterpenoid saponins from Silene vulgaris. J Nat Prod, 62(5), 717-721 doi:10.1021/np980505r