Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(OC(=O)NC1=CC=CC=C1)C#C
InChIKey
InChIKey=XZEPRXILIXFXNY-WOSSHHRXSA-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
Estrogens and derivatives 3-oxo delta-4-steroids Delta-4-steroids Phenylcarbamic acid esters Cyclohexenones Ynones Carbamate esters Acetylides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Steroid ester - Estrogen-skeleton - 3-oxosteroid - 3-oxo-delta-4-steroid - Estrane-skeleton - Oxosteroid - Delta-4-steroid - Phenylcarbamic acid ester - Cyclohexenone - Benzenoid - Ynone - Monocyclic benzene moiety - Carbamic acid ester - Cyclic ketone - Ketone - Acetylide - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - 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