Structure Information
Structure

Compound Identification

SMILES

CC(OC(=O)C1=CN=CC=C1)[C@]1(O)CC[C@@]2(O)[C@]1(C)[C@@H](CC1[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21O)OC(=O)\C=C\C1=CC=CC=C1

InChIKey

InChIKey=CQLUYSHACKIUHL-HRFTYYJFSA-N

Formula

C36H43NO8

Mass

617.739

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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

Gluco/mineralocorticoids, progestogins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Progestogin-skeleton - Steroid ester - 17-hydroxysteroid - 3-beta-hydroxysteroid - 3-beta-hydroxy-delta-5-steroid - Hydroxysteroid - 14-hydroxysteroid - 3-hydroxysteroid - 3-hydroxy-delta-5-steroid - Delta-5-steroid - Cinnamic acid ester - Cinnamic acid or derivatives - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Styrene - Benzenoid - Pyridine - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety.

External Descriptors

Not available

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