Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(O)CC43C)C(=O)OC3OCC(O)C(O)C3OC(=O)C=CC3=CC(OC)=C(OC4OC(CO)C(O)C(O)C4O)C=C3)C2(C)C)C(O)C(O)C1O

InChIKey

InChIKey=FQDYAELZPDIZMA-UHFFFAOYSA-N

Formula

C58H84O22

Mass

1133.288

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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 - Phenolic glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - Glycosyl compound - O-glycosyl compound - Tricarboxylic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Styrene - Methoxybenzene - Beta-hydroxy acid - Fatty acid ester - Alkyl aryl ether - Benzenoid - Monosaccharide - Pyran - Monocyclic benzene moiety - Hydroxy acid - Oxane - Fatty acyl - Cyclic alcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Secondary alcohol - Carboxylic acid ester - Ether - Acetal - Carboxylic acid derivative - Polyol - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Primary alcohol - Organic oxide - Organic oxygen compound - 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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