Compound Identification
SMILES
CCC(=O)O[C@@]1(CCC2C3C[C@H](F)C4=CC(=O)C=CC4(C)[C@@]3(F)C(O)CC12C)C(=O)COC(=O)C(C)C
InChIKey
InChIKey=ZHSRGZQSPBAHAM-CVYBOJHDSA-N
Formula
C28H36F2O7
Mass
522.586
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Pregnane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Gluco/mineralocorticoids, progestogins and derivatives
Alternative Parents
Steroid esters 20-oxosteroids 11-hydroxysteroids 3-oxo delta-1,4-steroids Halogenated steroids Delta-1,4-steroids Alpha-acyloxy ketones Dicarboxylic acids and derivatives Cyclic ketones Cyclic alcohols and derivatives Carboxylic acid esters Secondary alcohols Fluorohydrins Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - Steroid ester - 3-oxo-delta-1,4-steroid - 3-oxosteroid - 9-halo-steroid - 6-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 11-hydroxysteroid - Delta-1,4-steroid - Alpha-acyloxy ketone - Dicarboxylic acid or derivatives - Cyclic alcohol - Cyclic ketone - Ketone - Halohydrin - Secondary alcohol - Carboxylic acid ester - Fluorohydrin - Carboxylic acid derivative - Organofluoride - Organic oxygen compound - Alcohol - Organooxygen compound - Organic oxide - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Organohalogen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety.
External Descriptors
Not available