Compound Identification
SMILES
C[C@@H]1[C@@H](O)C(C)(C)N(C(=O)OC(C)(C)C)C2=C1C1=C(C=C2)C2=CC=CC=C2O[C@H]1C1=CC=C(Cl)C=C1
InChIKey
InChIKey=KSLMYADRFWEWLD-GJYHUBHWSA-N
Formula
C30H32ClNO4
Mass
506.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Hydroxysteroids
-
Level 5
12-hydroxysteroids
- Level 6 12-beta-hydroxysteroids
-
Level 5
12-hydroxysteroids
-
Subclass
Hydroxysteroids
-
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
Hydroxysteroids
Intermediate Tree Nodes
12-hydroxysteroids
Direct Parent
12-beta-hydroxysteroids
Alternative Parents
Dibenzopyrans Hydroquinolines 2-benzopyrans Chlorobenzenes Alkyl aryl ethers Aryl chlorides Carbamate esters Secondary alcohols Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
12-beta-hydroxysteroid - Dibenzopyran - Tetrahydroquinoline - Benzopyran - 1-benzopyran - 2-benzopyran - Halobenzene - Alkyl aryl ether - Chlorobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Carbamic acid ester - Secondary alcohol - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 12-beta-hydroxysteroids. These are hydroxysteroids carrying a beta-hydroxyl group at the 12-position.
External Descriptors
Not available