Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=C)[C@@](O)(C[C@H]34)C#C)[C@@H]1CCC2=O

InChIKey

InChIKey=VXJMLJNSTWATQE-QWSDNZPMSA-N

Formula

C21H26O2

Mass

310.437

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Estrane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Estrane steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Estrane-skeleton - 2-hydroxysteroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - Delta-4-steroid - Ynone - Tertiary alcohol - Ketone - Acetylide - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as estrane steroids. These are steroids with a structure based on the estrane skeleton.

External Descriptors

Not available

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