Compound Identification
SMILES
OC(=O)C(=O)C1=CC=C2C3CNCC(C3)CN2C1=O
InChIKey
InChIKey=VSLCWNDYPJOMNZ-UHFFFAOYSA-N
Formula
C13H14N2O4
Mass
262.265
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
Aryl ketones Pyridinones Aralkylamines Alpha-keto acids and derivatives Piperidines Alpha-hydroxy ketones Vinylogous amides Heteroaromatic compounds Amino acids Lactams Dialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - Aryl ketone - Aralkylamine - Pyridinone - Alpha-keto acid - Keto acid - Pyridine - Piperidine - Alpha-hydroxy ketone - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Amino acid - Ketone - Lactam - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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