Compound Identification
SMILES
CCOC(=O)CSC1=C(O)C2=C([C@H](CO)N3[C@@H](C2)[C@H]2[C@@H](C[C@@H](C3C#N)N2C)C(O)=O)C(O)=C1SCC(=O)OCC
InChIKey
InChIKey=ARDLIWJJOVVXSH-LAHVZQMOSA-N
Formula
C26H33N3O9S2
Mass
595.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Tetrahydroisoquinolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrahydroisoquinolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetrahydroisoquinolines
Alternative Parents
Tricarboxylic acids and derivatives Pyrrolidine carboxylic acids Thiophenol ethers Aralkylamines Azepanes N-methylpiperazines Alkylarylthioethers Phenols N-alkylpyrrolidines Alpha-aminonitriles Amino acids Carboxylic acid esters 1,2-aminoalcohols Trialkylamines Azacyclic compounds Carboxylic acids Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetrahydroisoquinoline - Tricarboxylic acid or derivatives - Aryl thioether - Thiophenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Azepane - Phenol - N-methylpiperazine - Aralkylamine - Alkylarylthioether - N-alkylpiperazine - 1,4-diazinane - N-alkylpyrrolidine - Benzenoid - Piperazine - Pyrrolidine - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Alpha-aminonitrile - Amino acid - Tertiary amine - Tertiary aliphatic amine - Sulfenyl compound - Thioether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Amine - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Primary alcohol - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.
External Descriptors
Not available