Compound Identification
SMILES
ClC1=CC(Cl)=C(C=C1)C1=CC=C(CCC(=O)N2CC3CC(C2)C2=CC=CC(=O)N2C3)O1
InChIKey
InChIKey=FJECVCLYJHCBSR-UHFFFAOYSA-N
Formula
C24H22Cl2N2O3
Mass
457.35
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 Dichlorobenzenes Pyridinones Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Furans Lactams Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - N-acyl-piperidine - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Pyridinone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyridine - Benzenoid - Tertiary carboxylic acid amide - Furan - Heteroaromatic compound - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - 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