Compound Identification
SMILES
FC(F)(F)C1=CC(=NC2=CC(=NN12)C(=O)OC[C@@H]1CCC[NH+]2CCCC[C@@H]12)C1=CC=CO1
InChIKey
InChIKey=QHHDQUUKSRBBNM-YOEHRIQHSA-O
Formula
C22H24F3N4O3
Mass
449.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Lupin alkaloids
- Subclass Lupinine-type alkaloids
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Class
Lupin alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Lupin alkaloids
Subclass
Lupinine-type alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Lupinine-type alkaloids
Alternative Parents
Quinolizines Quinolizidines Pyrazolo[1,5-a]pyrimidines Pyrazole carboxylic acids and derivatives Piperidines Pyrimidines and pyrimidine derivatives Furans Heteroaromatic compounds Quaternary ammonium salts Amino acids and derivatives Carboxylic acid esters Trialkylamines Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lupinine - Quinolizidine - Quinolizine - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Piperidine - Pyrimidine - Azole - Furan - Pyrazole - Heteroaromatic compound - Quaternary ammonium salt - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Organooxygen compound - Organic oxygen compound - Alkyl fluoride - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lupinine-type alkaloids. These are lupin alkaloids with a structure based on the lupinine skeleton, which is a bicyclic compound consisting of a quinolizidine.
External Descriptors
Not available