Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CC1=CC(=C(O)C=C1)[N+]([O-])=O)NC(=O)CON=C1CCC2(C)C3CCC4(C)C(CCC4C(C)=O)C3CCC2=C1

InChIKey

InChIKey=QEJFEIOBCOMMKR-UHFFFAOYSA-N

Formula

C33H43N3O8

Mass

609.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Pregnane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Pregnane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Pregnane-skeleton - 20-oxosteroid - Oxosteroid - Tyrosine or derivatives - Phenylalanine or derivatives - Delta-4-steroid - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Nitrophenol - Amphetamine or derivatives - Nitrobenzene - Nitroaromatic compound - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Methyl ester - Carboxamide group - Carboxylic acid ester - Organic nitro compound - Ketone - C-nitro compound - Oxime ether - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic salt - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic zwitterion - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as pregnane steroids. These are steroids with a structure based on the 21-carbon pregnane skeleton.

External Descriptors

Not available

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