Structure Information
Structure

Compound Identification

SMILES

[H][C@@](C)(CC(=O)CC(C)C)[C@@]1([H])CC[C@@]2([H])C3=C[C@@]4([H])OC[C@@]5([H])O[C@@]([H])(O[C@]6([H])[C@@]([H])(O)[C@@]([H])(O)[C@@]([H])(CO)O[C@@]6([H])O[C@]6([H])[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O[C@@]6([H])O[C@@]6([H])CC[C@](C)([C@@]3([H])CC[C@]12C)[C@@]4([H])C6)C([O-])=O)[C@]([H])(O)[C@@]([H])(O)[C@]5([H])O

InChIKey

InChIKey=SYTBXSURRJTIEH-NGDOLOPASA-M

Formula

C45H69O18

Mass

898.03

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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

Steroid glucuronide conjugates

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Diterpene glycoside - Steroid-glucuronide-skeleton - Cholesterol - Cholestane-skeleton - Oligosaccharide - Bile acid, alcohol, or derivatives - Diterpenoid - Delta-7-steroid - Terpene glycoside - Fatty acyl glycoside - Glucuronic acid or derivatives - Beta-hydroxy acid - Pyran - Oxane - Hydroxy acid - Fatty acyl - Secondary alcohol - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Acetal - Dialkyl ether - Oxacycle - Ether - Polyol - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Primary alcohol - Organooxygen compound - Organic oxide - Organic anion - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroid glucuronide conjugates. These are sterol lipids containing a glucuronide moiety linked to the steroid skeleton.

External Descriptors

Not available

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