Compound Identification
SMILES
CSCC[C@H](N)C(=O)N\N=C1/CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
InChIKey
InChIKey=YAHVJANRHDDMMG-GZNTYURCSA-N
Formula
C23H33N3O2S
Mass
415.6
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Estrane steroids
- Level 5 Estrogens and derivatives
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Subclass
Estrane steroids
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Class
Steroids and steroid derivatives
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Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrogens and derivatives
Alternative Parents
3-hydroxysteroids Phenanthrenes and derivatives Methionine and derivatives Tetralins 1-hydroxy-2-unsubstituted benzenoids Sulfenyl compounds Dialkylthioethers Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrogen-skeleton - 3-hydroxysteroid - Hydroxysteroid - Methionine or derivatives - Phenanthrene - Alpha-amino acid or derivatives - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Amino acid or derivatives - Sulfenyl compound - Thioether - Dialkylthioether - Carboxylic acid derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrogens and derivatives. These are steroids with a structure containing a 3-hydroxylated estrane.
External Descriptors
Not available