Structure Information
Structure

Compound Identification

SMILES

C[C@H]1C2C(CC3C4CC[C@H]5C[C@H](CC[C@]5(C)C4C(=O)C[C@]23C)O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](COC(=O)NC4=CC(F)=CC=C4)[C@@H](OC(=O)NC4=CC(F)=CC=C4)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)O[C@]11CC[C@@H](C)CO1

InChIKey

InChIKey=PCPZOAWXCNKZQF-MCMKQGFUSA-N

Formula

C53H70F2N2O16

Mass

1029.138

Export to:

JSON SDF CSV

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

Aromatic heteropolycyclic compounds

Substituents

Steroidal saponin - Triterpenoid - Spirostane skeleton - 11-oxosteroid - Oxosteroid - Disaccharide - Glycosyl compound - O-glycosyl compound - Phenylcarbamic acid ester - Ketal - Fluorobenzene - Halobenzene - Benzenoid - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Oxane - Carbamic acid ester - Tetrahydrofuran - Secondary alcohol - Ketone - Carbonic acid derivative - Oxacycle - Organoheterocyclic compound - Acetal - Organic oxide - Organohalogen compound - Organofluoride - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Primary alcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic 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

Previous Back Next