Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=C)[C@@](O)(C[C@H]34)C#C)[C@@H]1CCC2=O
InChIKey
InChIKey=VXJMLJNSTWATQE-QWSDNZPMSA-N
Formula
C21H26O2
Mass
310.437
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
Hydroxysteroids 17-oxosteroids Delta-4-steroids Ynones Tertiary alcohols Ketones Acetylides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Estrane-skeleton - 2-hydroxysteroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - Delta-4-steroid - Ynone - Tertiary alcohol - Ketone - Acetylide - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic homopolycyclic 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