Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OC(=O)C3=CC=C(N)C=C3)=C4)[C@@H]1CCC2=O

InChIKey

InChIKey=HLXWTRGOXQRLCY-APDHKMKFSA-N

Formula

C25H27NO3

Mass

389.495

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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 - 17-oxosteroid - Oxosteroid - Phenanthrene - Aminobenzoic acid or derivatives - Tetralin - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Ketone - Amino acid or derivatives - Carboxylic acid derivative - Amine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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

Not available

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