Structure Information
Structure

Compound Identification

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@]([H])(O)C[C@]([H])(O[C@@]6([H])OC[C@]([H])(O)[C@@]([H])(O)[C@]6([H])O[C@@]6([H])O[C@@]([H])(C)[C@]([H])(OC(C)=O)[C@@]([H])(OC(C)=O)[C@]6([H])OC(C)=O)[C@@]5(C)[C@@]4([H])CC[C@@]3(C)[C@@]1([H])[C@]([H])(C)[C@@]1(O2)OCC(=C)[C@@]([H])(O)[C@@]1([H])O

InChIKey

InChIKey=MBDYQOIVJMSYGC-CLHKOJBHSA-N

Formula

C44H64O17

Mass

864.979

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroidal glycosides

Intermediate Tree Nodes

Not available

Direct Parent

Steroidal saponins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Steroidal saponin - Triterpenoid - Spirostane skeleton - 24-hydroxysteroid - 23-hydroxysteroid - 3-hydroxy-delta-5-steroid - 3-hydroxysteroid - 3-alpha-hydroxysteroid - Hydroxysteroid - Delta-5-steroid - Disaccharide - Glycosyl compound - O-glycosyl compound - Tricarboxylic acid or derivatives - Ketal - Oxane - Cyclic alcohol - Tetrahydrofuran - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Polyol - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroidal saponins. These are saponins in which the aglycone moiety is a steroid. The steroidal aglycone is usually a spirostane, furostane, spirosolane, solanidane, or curcubitacin derivative.

External Descriptors

Not available

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