Compound Identification
SMILES
C[C@]12C[C@H](CCCCCCCCC(CCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O)C3C(CCC4=C3C=CC(O)=C4)C1CCC2=O
InChIKey
InChIKey=VOVQFDISTUIWBL-SFQGWBJESA-N
Formula
C35H45F9O4
Mass
700.727
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Estrane steroids
- Level 5 Estrogens and 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
Estrogens and derivatives
Alternative Parents
17-oxosteroids 3-hydroxysteroids Phenanthrenes and derivatives Tetralins Medium-chain fatty acids 1-hydroxy-2-unsubstituted benzenoids Branched fatty acids Halogenated fatty acids Hydroxy fatty acids Ketones Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrogen-skeleton - Hydroxysteroid - 3-hydroxysteroid - 17-oxosteroid - Oxosteroid - Phenanthrene - Tetralin - Medium-chain fatty acid - Phenol - Branched fatty acid - Halogenated fatty acid - Hydroxy fatty acid - 1-hydroxy-2-unsubstituted benzenoid - Fatty acid - Fatty acyl - Benzenoid - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organooxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxygen compound - Carbonyl group - Organic oxide - Organofluoride - Organohalogen compound - Alkyl halide - 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