Compound Identification
SMILES
FC1=C(F)C(F)=C(OC2=CC=C(NC(=O)N3CC4CC(C3)C3=CC=CC(=O)N3C4)C=C2)C(F)=C1F
InChIKey
InChIKey=VYUUKHXHVFEMGC-UHFFFAOYSA-N
Formula
C24H18F5N3O3
Mass
491.418
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
Diphenylethers Diarylethers N-phenylureas Piperidinecarboxamides Phenoxy compounds Phenol ethers Fluorobenzenes Pyridinones Aryl fluorides Heteroaromatic compounds Lactams Ureas Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - Diphenylether - Diaryl ether - N-phenylurea - 1-piperidinecarboxamide - Piperidinecarboxamide - Phenoxy compound - Phenol ether - Fluorobenzene - Halobenzene - Pyridinone - Aryl halide - Pyridine - Piperidine - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Heteroaromatic compound - Urea - Lactam - Azacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organofluoride - 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