Compound Identification
SMILES
CN1C[C@@H](C=C2[C@H]1CC1=CSC3=CC=CC2=C13)C(O)=O
InChIKey
InChIKey=ANYFTOINJBIPOI-NOZJJQNGSA-N
Formula
C16H15NO2S
Mass
285.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Thiaergolines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Thiaergolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiaergolines
Alternative Parents
Benzoquinolines Quinoline carboxylic acids 1-benzothiophenes Aralkylamines Benzenoids Thiophenes Heteroaromatic compounds Trialkylamines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiaergoline - Benzoquinoline - Quinoline-3-carboxylic acid - Quinoline - Benzothiophene - 1-benzothiophene - Aralkylamine - Benzenoid - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiaergolines. These are ergoline analogues, obtained by replacing the oxygen atom in the indole moiety (of the ergoline backbone) by a sulfur atom.
External Descriptors
Not available