Compound Identification
SMILES
COC(OC)C(=O)[C@H]1[C@@H](C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)OC[C@H]1O[C@H](C[C@@H]1N=[N+]=[N-])N1C=C(C)C(=O)NC1=O
InChIKey
InChIKey=BBYWZEDUJYYZLV-UHAKZCSZSA-N
Formula
C34H43N5O10
Mass
681.743
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
20-oxosteroids 11-beta-hydroxysteroids 3-oxo delta-1,4-steroids Delta-1,4-steroids Pyrimidine 2',3'-dideoxyribonucleosides Gamma-keto acids and derivatives Pyrimidones Hydropyrimidines Vinylogous amides Tetrahydrofurans Heteroaromatic compounds Azo compounds Azo imides Carboxylic acid esters Cyclic alcohols and derivatives Lactams Secondary alcohols Ureas Cyclic ketones Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-oxo-delta-1,4-steroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 11-beta-hydroxysteroid - 11-hydroxysteroid - Delta-1,4-steroid - Pyrimidine 2',3'-dideoxyribonucleoside - Pyrimidine nucleoside - Gamma-keto acid - Pyrimidone - Hydropyrimidine - Keto acid - Pyrimidine - Vinylogous amide - Cyclic alcohol - Heteroaromatic compound - Tetrahydrofuran - Azo compound - Azo imide - Carboxylic acid ester - Cyclic ketone - Ketone - Lactam - Urea - Secondary alcohol - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Acetal - Carbonyl group - Organic zwitterion - Organic nitrogen compound - Alcohol - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen 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