Compound Identification
SMILES
CNc1ccccc1C(=O)OC(C)C1(O)CCC2(O)C1(C)C(CC1C3(C)CCC(O)CC3CCC21O)OC(C)=O
InChIKey
InChIKey=GXOQDIXPHLIEBB-UHFFFAOYSA-N
Formula
C31H45NO8
Mass
559.7
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 Aminobenzoic acids and derivatives Benzoic acid esters Phenylalkylamines Aniline and substituted anilines Benzoyl derivatives Secondary alkylarylamines Dicarboxylic acids and derivatives Tertiary alcohols Vinylogous amides Cyclic alcohols and derivatives Carboxylic acid esters Amino acids and derivatives Secondary alcohols Polyols Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Progestogin-skeleton - Steroid ester - 3-hydroxysteroid - 14-hydroxysteroid - 17-hydroxysteroid - Hydroxysteroid - Aminobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Tertiary alcohol - Vinylogous amide - Cyclic alcohol - Secondary alcohol - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Polyol - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Alcohol - Amine - Organonitrogen compound - 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