Compound Identification
SMILES
COC(=O)C1=CC=C(CN2C(=O)C3C(NC(CCSC)(C3C2=O)C(O)=O)C2=CC=CC=C2OC)C=C1
InChIKey
InChIKey=FYIOEZASHVGWSZ-UHFFFAOYSA-N
Formula
C26H28N2O7S
Mass
512.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Alpha amino acids Benzoic acid esters Pyrrolidine carboxylic acids Anisoles Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Aralkylamines Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Pyrroles Methyl esters Amino acids Lactams Dialkylthioethers Dialkylamines Carboxylic acids Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzoate ester - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoic acid or derivatives - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Benzoyl - Phenoxy compound - Methoxybenzene - Anisole - Aralkylamine - Alkyl aryl ether - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Methyl ester - Carboxylic acid imide - Dicarboximide - Pyrrole - Amino acid - Carboxylic acid ester - Lactam - Amino acid or derivatives - Azacycle - Dialkylthioether - Sulfenyl compound - Thioether - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Organic oxide - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available