Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OCC=C)=C4)[C@@H]1C[C@@H](O)[C@@H]2O

InChIKey

InChIKey=GVKVGOGUDSJCLX-YQPXSLGVSA-N

Formula

C21H28O3

Mass

328.452

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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

Aromatic homopolycyclic compounds

Substituents

Estrane-skeleton - Hydroxysteroid - 16-alpha-hydroxysteroid - 17-hydroxysteroid - 16-hydroxysteroid - Phenanthrene - Tetralin - Alkyl aryl ether - Benzenoid - Cyclic alcohol - Secondary alcohol - 1,2-diol - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aromatic 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

CHEBI:79756 : 17beta-hydroxy steroid - 16alpha-hydroxy steroid

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