Structure Information
Structure

Compound Identification

SMILES

[H]C12CCC3([H])[C@@](C)(O)OCC13C[C@@]([H])(O)C1([H])C2([H])CCC2=CC(=O)C=C[C@]12C

InChIKey

InChIKey=XVJVYYOTHOAHCB-VAAAFYKXSA-N

Formula

C21H28O4

Mass

344.451

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Oxosteroids

Intermediate Tree Nodes

Not available

Direct Parent

Oxosteroids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

20-hydroxysteroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 11-hydroxysteroid - 11-alpha-hydroxysteroid - Cyclic alcohol - Tetrahydrofuran - Hemiacetal - Ketone - Secondary alcohol - Cyclic ketone - Oxacycle - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as oxosteroids. These are steroid derivatives carrying a C=O group attached to steroid skeleton.

External Descriptors

Not available

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