Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C1NC(CC2=CNC3=CC=CC=C23)(C2C1C(=O)N(C2=O)C1=CC=CC=C1C)C(O)=O
InChIKey
InChIKey=SANMUBHEOMTSIM-UHFFFAOYSA-N
Formula
C31H27N3O6
Mass
537.572
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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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
3-alkylindoles Alpha amino acids Benzoic acid esters Pyrrolidine carboxylic acids Benzoyl derivatives Toluenes Aralkylamines Substituted pyrroles Pyrrolidine-2-ones N-substituted carboxylic acid imides Heteroaromatic compounds Dicarboximides Methyl esters Amino acids Lactams Dialkylamines Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - 3-alkylindole - Indole or derivatives - Benzoic acid or derivatives - Indole - Benzoyl - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aralkylamine - Toluene - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Substituted pyrrole - Pyrrolidone - 2-pyrrolidone - Pyrrole - Dicarboximide - Carboxylic acid imide - Heteroaromatic compound - Methyl ester - Amino acid or derivatives - Amino acid - Carboxylic acid ester - Lactam - Secondary aliphatic amine - Carboxylic acid - Secondary amine - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - 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