Structure Information
Structure

Compound Identification

SMILES

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@](C)(CC(O)=O)[C@@H](CCC34C)C(C)=C)[C@@H]12)C(O)=O

InChIKey

InChIKey=IRRPUWFFVIPXCD-QGJKCWITSA-N

Formula

C29H44O4

Mass

456.667

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid acids

Intermediate Tree Nodes

Not available

Direct Parent

3-carboxy steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

3-carboxy steroid - Androstane-skeleton - 18-oxosteroid - 18-hydroxysteroid - Hydroxysteroid - 16-oxosteroid - Oxosteroid - 16-hydroxysteroid - Dicarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-carboxy steroids. These are steroid compounds that carry a carboxyl group at the C3-atom of the steroid backbone.

External Descriptors

Not available

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