Structure Information
Structure

Compound Identification

SMILES

[Na+].C[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](CO[C@H]2O[C@H]2CC[C@@]3(C)[C@@H](CC[C@@H]4C3=C[C@H](O)[C@]35C(=O)O[C@@](C)([C@H]6CCC(C)(C)O6)[C@@]3(O)CC[C@@]45C)C2(C)C)OS([O-])(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=XPKZSKANINADOD-CWUUJGLNSA-M

Formula

C41H63NaO17S

Mass

882.99

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene glycosides

Intermediate Tree Nodes

Triterpene glycosides

Direct Parent

Triterpene saponins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Triterpene saponin - Triterpenoid - Steroidal glycoside - Steroid lactone - 12-hydroxysteroid - Hydroxysteroid - 17-hydroxysteroid - Steroid - Disaccharide - Glycosyl compound - O-glycosyl compound - Gamma butyrolactone - Oxane - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Alkyl sulfate - Tetrahydrofuran - Tertiary alcohol - Organic sulfuric acid or derivatives - Cyclic alcohol - Carboxylic acid ester - Secondary alcohol - Lactone - Organoheterocyclic compound - Carboxylic acid derivative - Polyol - Organic alkali metal salt - Monocarboxylic acid or derivatives - Oxacycle - Dialkyl ether - Acetal - Ether - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Alcohol - Organic sodium salt - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triterpene saponins. These are glycosylated derivatives of triterpene sapogenins. The sapogenin moiety backbone is usually based on the oleanane, ursane, taraxastane, bauerane, lanostane, lupeol, lupane, dammarane, cycloartane, friedelane, hopane, 9b,19-cyclo-lanostane, cycloartane, or cycloartanol skeleton.

External Descriptors

Not available

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