Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1CC[C@H]2[C@@H]3C=CC4=C(O)C(O)C=C[C@@H]4[C@H]3CC[C@]12C

InChIKey

InChIKey=ODQNJOTUXGHJGQ-SIMYAGOXSA-N

Formula

C19H26O3

Mass

302.414

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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

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Estrogen-skeleton - Hydroxysteroid - 4-hydroxysteroid - 3-hydroxysteroid - 3-hydroxy-delta-1,4-steroid - Delta-1,4-steroid - Secondary alcohol - Ether - Enol - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - 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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