Compound Identification
SMILES
CCCN1CCO[C@H]2[C@H]1C[C@@H]1CNC3=CC=CC2=C13
InChIKey
InChIKey=OXOXQLCRBAXCQT-DJSGYFEHSA-N
Formula
C16H22N2O
Mass
258.365
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Oxaergolines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Oxaergolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxaergolines
Alternative Parents
Tetralins Isoindoles and derivatives Indolines Secondary alkylarylamines Aralkylamines Morpholines Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oxaergoline skeleton - Tetralin - Indole or derivatives - Dihydroindole - Isoindole or derivatives - Secondary aliphatic/aromatic amine - Aralkylamine - Benzenoid - Oxazinane - Morpholine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Secondary amine - Organoheterocyclic compound - Oxacycle - Dialkyl ether - Ether - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxaergolines. These are alkaloids with a structure based on the oxaergoline skeleton, an analog of ergoline obtained by substituted one of the pyridine C atom by an oxygen atom.
External Descriptors
Not available