Compound Identification
SMILES
CC(C)C(NC(=O)N1CC2CC(C1)C1=CC=CC(=O)N1C2)C(=O)NC1=CC=CC=C1Cl
InChIKey
InChIKey=FSCBMFCABNKKDY-UHFFFAOYSA-N
Formula
C23H27ClN4O3
Mass
442.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Lupin alkaloids
- Subclass Cytisine and derivatives
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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
Valine and derivatives N-carbamoyl-alpha amino acids and derivatives Alpha amino acid amides Anilides Piperidinecarboxamides N-arylamides Pyridinones Chlorobenzenes Fatty amides Aryl chlorides Heteroaromatic compounds Ureas Lactams Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - N-carbamoyl-alpha-amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Anilide - 1-piperidinecarboxamide - Piperidinecarboxamide - N-arylamide - Halobenzene - Chlorobenzene - Pyridinone - Aryl chloride - Aryl halide - Fatty amide - Monocyclic benzene moiety - Fatty acyl - Piperidine - Benzenoid - Pyridine - Heteroaromatic compound - Carboxamide group - Lactam - Carbonic acid derivative - Secondary carboxylic acid amide - Urea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - 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