Structure Information
Structure

Compound Identification

SMILES

CC12CCCC1C1=C(C(=O)C2)C2=C(C=C1)C=C(OC(=O)C1=CC=C(C=C1)[N+]([O-])=O)C=C2

InChIKey

InChIKey=WUXJXODVXRKBCJ-UHFFFAOYSA-N

Formula

C25H21NO5

Mass

415.445

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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 - 11-oxosteroid - Oxosteroid - Delta-7-steroid - Phenanthrene - Nitrobenzoate - Benzoate ester - Naphthalene - Phenol ester - Tetralin - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Aryl ketone - Benzenoid - Monocyclic benzene moiety - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Ketone - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organic cation - 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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