Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.CC(C)N1CC(CCN2CCOCC2)C(C2CCCC2)(C1=O)C1=CC=CC=C1
InChIKey
InChIKey=KYPOKQWXWAPCFT-BTJKTKAUSA-N
Formula
C28H40N2O6
Mass
500.636
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
Aralkylamines Unsaturated fatty acids Pyrrolidine-2-ones N-alkylpyrrolidines Morpholines Benzene and substituted derivatives Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Pyrroles Trialkylamines Amino acids and derivatives Lactams Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
3-phenylpyrrolidine - Aralkylamine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Morpholine - Oxazinane - Pyrrolidone - Fatty acyl - Fatty acid - Benzenoid - N-alkylpyrrolidine - Unsaturated fatty acid - 2-pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Carboxamide group - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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