Compound Identification
SMILES
COC1=CC=C(NC(=O)CCC(=O)N2CC3CC(C2)C2=CC=CC(=O)N2C3)C=C1
InChIKey
InChIKey=BEIDYBTYYJJYDG-UHFFFAOYSA-N
Formula
C22H25N3O4
Mass
395.459
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
Anilides Methoxyanilines N-acylpiperidines Anisoles Methoxybenzenes N-arylamides Phenoxy compounds Alkyl aryl ethers Pyridinones Fatty amides Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Amino acids and derivatives Tertiary amines Lactams Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - N-acyl-piperidine - Anilide - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - N-arylamide - Alkyl aryl ether - Pyridinone - Monocyclic benzene moiety - Fatty amide - Piperidine - Pyridine - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Amine - 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