Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)[C@@H]1N(CC[NH+]2CCOCC2)C(=O)C(=O)C1=C(O)C1=CC2=C(O[C@@H](C)C2)C=C1
InChIKey
InChIKey=CJFDEOMSEUMLKX-GKVSMKOHSA-O
Formula
C29H35N2O8
Mass
539.604
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Coumarans Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Morpholines N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Quaternary ammonium salts Tertiary carboxylic acid amides Pyrroles Amino acids and derivatives Lactams Cyclic ketones Trialkylamines Enols Dialkyl ethers Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Coumaran - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Vinylogous acid - Pyrrole - Tertiary amine - Ketone - Lactam - Carboxamide group - Cyclic ketone - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Azacycle - Ether - Enol - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic cation - 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