Structure Information
Structure

Compound Identification

SMILES

CSC(=O)CC(=O)OC(CC1(C)OC1(C)C)C(C)C1CCC2C3C(O)CC4=CC(=O)CC(OC(C)=O)C4(C)C3CCC12C

InChIKey

InChIKey=OHEDEHGBHXSULQ-UHFFFAOYSA-N

Formula

C34H50O8S

Mass

618.83

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Bile acids, alcohols and derivatives

Intermediate Tree Nodes

Hydroxy bile acids, alcohols and derivatives

Direct Parent

Monohydroxy bile acids, alcohols and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cholesterol-skeleton - Cholestane-skeleton - Monohydroxy bile acid, alcohol, or derivatives - Steroid ester - 3-oxo-delta-4-steroid - 3-oxosteroid - Hydroxysteroid - 7-hydroxysteroid - Oxosteroid - Delta-4-steroid - Cyclohexenone - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Cyclic alcohol - Carboxylic acid ester - Carbothioic s-ester - Cyclic ketone - Ketone - Thiocarboxylic acid ester - Secondary alcohol - Ether - Oxirane - Dialkyl ether - Organoheterocyclic compound - Oxacycle - Sulfenyl compound - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Alcohol - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as monohydroxy bile acids, alcohols and derivatives. These are bile acids, alcohols or any of their derivatives bearing a hydroxyl group.

External Descriptors

Not available

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