Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@]34C)OCCO5)[C@@H]1CC[C@]2(O)C#N
InChIKey
InChIKey=VRSHJJXUDZAQKD-CEGNMAFCSA-N
Formula
C22H31NO3
Mass
357.494
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Estrane steroids
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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
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrane steroids
Alternative Parents
17-hydroxysteroids Delta-5-steroids Ketals Tertiary alcohols 1,3-dioxolanes Cyclic alcohols and derivatives Cyanohydrins Alpha-hydroxynitriles Oxacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
17-hydroxysteroid - Hydroxysteroid - Estrane-skeleton - Delta-5-steroid - Ketal - Tertiary alcohol - Cyclic alcohol - Meta-dioxolane - Alpha-hydroxynitrile - Cyanohydrin - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrane steroids. These are steroids with a structure based on the estrane skeleton.
External Descriptors
Not available