Structure Information
Structure

Compound Identification

SMILES

C[C@]12C=CC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CCC2=O

InChIKey

InChIKey=KBSXJBBFQODDTQ-RYRKJORJSA-N

Formula

C18H20O2

Mass

268.356

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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

Estrogens and derivatives

Alternative Parents

3-oxosteroids 17-oxosteroids Cyclohexenones Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Estrogen-skeleton - Oxosteroid - 17-oxosteroid - 3-oxosteroid - Cyclohexenone - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as estrogens and derivatives. These are steroids with a structure containing a 3-hydroxylated estrane.

External Descriptors

Not available

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