Compound Identification
SMILES
COC1=CC=C(C=C1)N1C[C@@H](C(C(=O)O[C@@H]2[C@H]3CC[C@@](C)([C@@H]2C2=CC=CC4=CC=CC=C24)C3(C)C)C1=O)C1CCCCC1
InChIKey
InChIKey=IHDLWXCCZYBMHE-IEVJFNDLSA-N
Formula
C38H45NO4
Mass
579.781
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
Aromatic monoterpenoids Bicyclic monoterpenoids Naphthalenes Methoxyanilines Anisoles Pyrrolidine carboxylic acids Methoxybenzenes Oxoprolines Phenoxy compounds Alkyl aryl ethers 1,3-dicarbonyl compounds Pyrrolidine-2-ones Pyrroles Tertiary carboxylic acid amides Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Aromatic monoterpenoid - Bornane monoterpenoid - Norbornane monoterpenoid - Monoterpenoid - Naphthalene - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Oxoproline - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - 2-pyrrolidone - Pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Azacycle - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organonitrogen 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