Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C#C.CC(CC1=CC2=C(C=C1)C1CC[C@@]3(C)C(CCC3(O)C#C)C1CC2)S(O)(=O)=O

InChIKey

InChIKey=HESCMCKQENPQSO-FSOKOXAQSA-N

Formula

C45H58O7S

Mass

743.01

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid esters

Intermediate Tree Nodes

Not available

Direct Parent

Steroid esters

Alternative Parents

Molecular Framework

Not available

Substituents

Steroid ester - Estrogen-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Estrane-skeleton - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Delta-4-steroid - Phenanthrene - Tetralin - Cyclohexenone - Ynone - Benzenoid - Tertiary alcohol - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Cyclic alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Acetylide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organosulfur compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroid esters. These are compounds containing a steroid moiety which bears a carboxylic acid ester group.

External Descriptors

Not available

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