Compound Identification
SMILES
CC12CCC3C(CCC4=C3C=CC(OCCN3C=NC5=C3N=CN=C5N)=C4[N+]([O-])=O)C1CCC2=O
InChIKey
InChIKey=RJBZDWOHKVHYFY-UHFFFAOYSA-N
Formula
C25H28N6O4
Mass
476.537
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Estrane steroids
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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
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrane steroids
Alternative Parents
17-oxosteroids Phenanthrenes and derivatives Nitronaphthalenes Tetralins 6-aminopurines Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles Heteroaromatic compounds Ketones Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic salts Organic zwitterions Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Estrane-skeleton - 17-oxosteroid - Oxosteroid - Phenanthrene - 1-nitronaphthalene - 6-aminopurine - Tetralin - Imidazopyrimidine - Purine - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Aminopyrimidine - N-substituted imidazole - Benzenoid - Imidolactam - Pyrimidine - Imidazole - Azole - Heteroaromatic compound - Ketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic zwitterion - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Primary amine - Amine - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrane steroids. These are steroids with a structure based on the estrane skeleton.
External Descriptors
Not available