Compound Identification
SMILES
O[C@H]1CCC[C@]2(CCC[C@@H](C\C=C/C=C)N2)[C@@H]1\C=C/C=C
InChIKey
InChIKey=DQLZNDOWVBOLDA-AFVFYVOOSA-N
Formula
C19H29NO
Mass
287.447
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 Piperidines Secondary alcohols Cyclic alcohols and derivatives Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Histrionicotoxin skeleton - Azaspirodecane - Piperidine - Cyclic alcohol - Secondary alcohol - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organopnictogen 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