Compound Identification
SMILES
CC(OC(=O)c1cccnc1)C1(O)CCC2(O)C1(C)C(CC1C3(C)CCC(O)CC3CCC21O)OC(=O)C=Cc1ccccc1
InChIKey
InChIKey=WDONRBOXEHSLOP-UHFFFAOYSA-N
Formula
C36H45NO8
Mass
619.755
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 14-hydroxysteroids 17-hydroxysteroids 3-hydroxysteroids Cinnamic acid esters Pyridinecarboxylic acids Styrenes Dicarboxylic acids and derivatives Heteroaromatic compounds Enoate esters Tertiary alcohols Cyclic alcohols and derivatives Secondary alcohols Azacyclic compounds Polyols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Progestogin-skeleton - Steroid ester - 3-hydroxysteroid - 14-hydroxysteroid - Hydroxysteroid - 17-hydroxysteroid - Cinnamic acid or derivatives - Cinnamic acid ester - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Styrene - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyridine - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tertiary alcohol - Heteroaromatic compound - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Polyol - Alcohol - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic 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