Compound Identification
SMILES
OC1=CC(=O)NC(SCC(=O)N2CC3CC(C2)C2=CC=CC(=O)N2C3)=N1
InChIKey
InChIKey=ZIMRYGMCZYKLBF-UHFFFAOYSA-N
Formula
C17H18N4O4S
Mass
374.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Lupin alkaloids
- Subclass Cytisine and derivatives
-
Class
Lupin alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Lupin alkaloids
Subclass
Cytisine and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Cytisine and derivatives
Alternative Parents
N-acylpiperidines Alkylarylthioethers Hydroxypyrimidines Pyridinones Pyrimidones Hydropyrimidines Vinylogous acids Heteroaromatic compounds Tertiary carboxylic acid amides Lactams Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - N-acyl-piperidine - Aryl thioether - Pyridinone - Pyrimidone - Alkylarylthioether - Hydroxypyrimidine - Hydropyrimidine - Piperidine - Pyridine - Pyrimidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous acid - Carboxamide group - Lactam - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cytisine and derivatives. These are lupin alkaloids with a structure based on the cytisine skeleton, which is a tetracyclic ketone containing fused pyridine and piperidine rings that form pyrido[1,2a][1,5]diazocin-8-one.
External Descriptors
Not available