Compound Identification
SMILES
CCCCC[C@@H]1CCC[C@]23CCC[C@H](ON12)[C@H]3\C=C/CC
InChIKey
InChIKey=LRDWIAIFNPDIPY-DTRHCTSISA-N
Formula
C19H33NO
Mass
291.479
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Histrionicotoxins
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Histrionicotoxins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Histrionicotoxins
Alternative Parents
Azaspirodecane derivatives 1,2-oxazepines Piperidines Isoxazolidines Oxacyclic compounds N-organohydroxylamines Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Histrionicotoxin skeleton - Azaspirodecane - Ortho-oxazepine - Piperidine - Isoxazolidine - Oxacycle - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as histrionicotoxins. These are frog toxins structurally characterized by the presence of a dodecahydropyrrolo[1,2-a]quinolin-1-yl}ethanol moiety or a 2,7-disubstituted 1-azaspiro[5.5]undecan-8-ol moiety.
External Descriptors
Not available