Compound Identification
SMILES
COC(=O)C1=C(N)C2=C(N)OC3=CC=CC=C3C2CC1=C(C#N)C#N
InChIKey
InChIKey=WCQUAMDDMHHNHT-UHFFFAOYSA-N
Formula
C18H14N4O3
Mass
334.335
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Oxosteroids
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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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
Oxosteroids
Alternative Parents
17-oxosteroids 1-benzopyrans Aromatic monoterpenoids Benzenoids Vinylogous amides Enoate esters Methyl esters Amino acids and derivatives Ketene acetals Monocarboxylic acids and derivatives Enamines Nitriles Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
17-oxosteroid - Oxosteroid - Aromatic monoterpenoid - Benzopyran - Monoterpenoid - 1-benzopyran - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Ketene acetal or derivatives - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Oxacycle - Carbonitrile - Nitrile - Organoheterocyclic compound - Primary aliphatic amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxosteroids. These are steroid derivatives carrying a C=O group attached to steroid skeleton.
External Descriptors
Not available