Compound Identification
SMILES
CCOC(=O)N1CCN(CC1)C(=O)CC(=O)CN1CC2CC(C1)C1=CC=CC(=O)N1C2
InChIKey
InChIKey=JDKFBEYXECLFIG-UHFFFAOYSA-N
Formula
C22H30N4O5
Mass
430.505
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
Piperazine carboxylic acids Pyridinones Aralkylamines Piperidines 1,3-dicarbonyl compounds Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Alpha-amino ketones Trialkylamines Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - Piperazine-1-carboxylic acid - Pyridinone - Aralkylamine - 1,4-diazinane - Piperazine - Piperidine - Pyridine - 1,3-dicarbonyl compound - Carbamic acid ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Alpha-aminoketone - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Lactam - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Amine - 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