Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1OC(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC2=C[C@@H]3C(=CCC4[C@]5(C)C[C@H]6O[C@@H](C[C@](C)(O)[C@@H]6[C@@]5(C)CC(=O)[C@@]34C)\C=C(/C)CO)C(C)(C)C2=O)[C@H](O)[C@H](O)[C@H]1O

InChIKey

InChIKey=BEQDSDZQSKPXIG-ZXQPFUTHSA-N

Formula

C42H62O15

Mass

806.943

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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

Steroidal saponins

Direct Parent

Cucurbitacin glycosides

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cucurbitacin glycoside skeleton - Diterpene glycoside - 20-hydroxysteroid - Diterpenoid - 3-oxosteroid - 3-oxo-delta-1-steroid - Hydroxysteroid - Oxosteroid - 11-oxosteroid - 14-alpha-methylsteroid - Delta-1-steroid - Terpene glycoside - Disaccharide - O-glycosyl compound - Glycosyl compound - Cyclohexenone - Oxane - Tertiary alcohol - Ketone - Cyclic ketone - Secondary alcohol - Acetal - Oxacycle - Dialkyl ether - Organoheterocyclic compound - Polyol - Ether - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Alcohol - Aldehyde - Organic oxygen compound - Primary alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cucurbitacin glycosides. These are polycyclic compounds containing a carbohydrate derivative glycosidically linked to a curcubitane nucleus.

External Descriptors

Not available

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