Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C(=O)[C@H]4C[C@@H](F)CC[C@]4(C)[C@H]3CC[C@]12C

InChIKey

InChIKey=IZBIOKRFDKMUEU-YYMTUFQNSA-N

Formula

C25H39FO4

Mass

422.581

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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 homopolycyclic compounds

Substituents

Monohydroxy bile acid, alcohol, or derivatives - 3-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 7-hydroxysteroid - 6-oxosteroid - Fatty acid methyl ester - Fatty acid ester - Fatty acyl - Methyl ester - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Alcohol - Alkyl fluoride - Organic oxygen compound - Organohalogen compound - Organofluoride - Organooxygen compound - Alkyl halide - Carbonyl group - Hydrocarbon derivative - Aliphatic homopolycyclic 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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