Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)C1=CC=CC=C1C#N
InChIKey
InChIKey=TZRNKHTWSSBGQA-ZLQWOROUSA-N
Formula
C27H31NO3
Mass
417.549
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Steroid esters
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
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
Androgens and derivatives 3-oxo delta-4-steroids Delta-4-steroids Benzoic acid esters Benzoyl derivatives Benzonitriles Cyclohexenones Carboxylic acid esters Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Steroid ester - Androgen-skeleton - Androstane-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - Benzoate ester - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Cyclohexenone - Monocyclic benzene moiety - Benzenoid - Cyclic ketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Nitrile - Carbonitrile - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Cyanide - 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