Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCC1=NC(C#N)=C(N)O1)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)CC4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@@H](O)[C@]12C

InChIKey

InChIKey=OHPBWXLHDZTONA-REGAAARSSA-N

Formula

C27H41N3O4

Mass

471.642

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Hydroxysteroids

Intermediate Tree Nodes

7-hydroxysteroids

Direct Parent

7-alpha-hydroxysteroids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-hydroxysteroid - 12-hydroxysteroid - 7-alpha-hydroxysteroid - 3-beta-hydroxysteroid - 2,4,5-trisubstituted 1,3-oxazole - Azole - Cyclic alcohol - Heteroaromatic compound - Oxazole - Secondary alcohol - Oxacycle - Carbonitrile - Nitrile - Azacycle - Polyol - Organoheterocyclic compound - Alcohol - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-alpha-hydroxysteroids. These are steroids carrying a alpha-hydroxyl group at the 7-position of the steroid backbone.

External Descriptors

Not available

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