Structure Information
Structure

Compound Identification

SMILES

C\C=C(\C)C(=O)O[C@H]1[C@H](OC(=O)\C=C\C2=CC=CC=C2)[C@]23[C@@H](O)O[C@@]4(CCC5[C@@]6(C)CC[C@H](O[C@@H]7OC([C@@H](O)C(O[C@@H]8OC(CO)[C@H](O)C(O)[C@@H]8OC8O[C@@H](C)C(O)[C@H](O)C8OC8O[C@@H](C)[C@H](O)C(O)[C@@H]8O)[C@@H]7O[C@@H]7OC(CO)[C@@H](O)C(O)[C@@H]7O)C(O)=O)C(C)(C)C6CC[C@@]5(C)[C@]4(C)C[C@H]2O)C3CC1(C)C

InChIKey

InChIKey=JFWFXEOYRZGWQD-ABVQKPSOSA-N

Formula

C74H110O32

Mass

1511.662

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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

Aromatic heteropolycyclic compounds

Substituents

Triterpene saponin - Triterpenoid - Oligosaccharide - Fatty acyl glycoside - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - O-glycosyl compound - Glycosyl compound - Tricarboxylic acid or derivatives - Styrene - Beta-hydroxy acid - Fatty acid ester - Oxepane - Hydroxy acid - Monocyclic benzene moiety - Pyran - Fatty acyl - Benzenoid - Oxane - Cyclic alcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Secondary alcohol - Hemiacetal - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Carboxylic acid - Acetal - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Alcohol - Aromatic 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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