Structure Information
Structure

Compound Identification

SMILES

CNC(=O)CCCCCCCCCC[C@@H]1CC2=C(C=CC(O)=C2)C2CC[C@@]3(C)C(C=CC3=O)C12

InChIKey

InChIKey=WNXFMMIHLCMMSE-MFNCESDPSA-N

Formula

C30H43NO3

Mass

465.678

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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

Aromatic homopolycyclic compounds

Substituents

Estrogen-skeleton - 3-hydroxysteroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - Phenanthrene - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Ketone - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic 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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