Structure Information
Structure

Compound Identification

SMILES

CC12CCC3C(CC4=NN(CC5=CC=C(C=C5)[N+]([O-])=O)C5=C4C3(C)CCC5=O)C1CCC2=O

InChIKey

InChIKey=UYNSRKBUFVSFKD-UHFFFAOYSA-N

Formula

C26H29N3O4

Mass

447.535

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Steroids and steroid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Steroid - Nitrobenzene - Nitroaromatic compound - Aryl alkyl ketone - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Ketone - C-nitro compound - Organic nitro compound - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic zwitterion - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroids and steroid derivatives. These are compounds based on the cyclopenta[a]phenanthrene carbon skeleton, partially or completely hydrogenated; there are usually methyl groups at C-10 and C-13, and often an alkyl group at C-17. By extension, one or more bond scissions, ring expansions and/or ring contractions of the skeleton may have occurred.

External Descriptors

Not available

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