Compound Identification
SMILES
CSCC1CN(C)C2CC3C=NC4=CC=CC(C2O1)=C34
InChIKey
InChIKey=BXABQQRDEHOKCO-UHFFFAOYSA-N
Formula
C16H20N2OS
Mass
288.41
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 3-alkylindoles Isoindoles and derivatives Aralkylamines Morpholines Trialkylamines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Dialkylthioethers Dialkyl ethers Azacyclic compounds Imines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oxaergoline skeleton - Tetralin - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aralkylamine - Benzenoid - Oxazinane - Morpholine - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Sulfenyl compound - Thioether - Azacycle - Ether - Dialkyl ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Imine - Organosulfur compound - Organic nitrogen compound - Organic oxygen 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