Compound Identification
SMILES
CO[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)\C=C/[125I])[C@@H]2CCC3=C(C=CC(O)=C3)[C@@H]12
InChIKey
InChIKey=OODBRCOEGXETBA-UHHJKBSISA-N
Formula
C21H27IO3
Mass
452.349
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
3-hydroxysteroids 17-hydroxysteroids Phenanthrenes and derivatives Tetralins 1-hydroxy-2-unsubstituted benzenoids Tertiary alcohols Cyclic alcohols and derivatives Vinyl iodides Iodoalkenes Dialkyl ethers Organoiodides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 3-hydroxysteroid - Hydroxysteroid - 17-hydroxysteroid - Phenanthrene - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Cyclic alcohol - Tertiary alcohol - Haloalkene - Iodoalkene - Dialkyl ether - Ether - Vinyl iodide - Vinyl halide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organoiodide - Organooxygen compound - Alcohol - Aromatic 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