Compound Identification
SMILES
CCCN1CC(C)C=C2[C@@H]1CC1CNC3=CC=CC2=C13
InChIKey
InChIKey=PCXDSVMGNSSSQR-FVKWTLKZSA-N
Formula
C18H24N2
Mass
268.404
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Ergoline and derivatives
- Subclass Clavines and derivatives
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Class
Ergoline and derivatives
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ergoline and derivatives
Subclass
Clavines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Clavines and derivatives
Alternative Parents
6,7-secoergolines Benzoquinolines Tetralins Isoindoles and derivatives Indolines Secondary alkylarylamines Aralkylamines Trialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Clavine skeleton - 6,7-secoergoline - Benzoquinoline - Quinoline - Tetralin - Indole or derivatives - Dihydroindole - Isoindole or derivatives - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Secondary amine - Amine - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as clavines and derivatives. These are hydroxy and dehydro derivatives of 6,8-dimethylergolenes and the corresponding ergolines.
External Descriptors
Not available