Compound Identification
SMILES
CCC12CC[C@H]3[C@@H](CC[C@]45O[C@@H]4C(=O)CC[C@H]35)[C@@H]1CCC2(O)C#C
InChIKey
InChIKey=QAADEDKZKKRMIM-UPNZZDETSA-N
Formula
C21H28O3
Mass
328.452
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Estrane steroids
-
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
Oxepanes Ynones Monosaccharides Tertiary alcohols Ketones Cyclic alcohols and derivatives Oxacyclic compounds Haloacetylenes and derivatives Epoxides Dialkyl ethers Acetylides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Estrane-skeleton - Oxepane - Ynone - Monosaccharide - Tertiary alcohol - Cyclic alcohol - Ketone - Haloacetylene or derivatives - Acetylide - Oxacycle - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen 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