Compound Identification
SMILES
CCOC1=C(OCC)C=C(C=C1)[C@H]1N(C(=O)C(=O)C1=C(O)C1=CC2=C(O[C@H](C)C2)C=C1)C1=NN=C(C)S1
InChIKey
InChIKey=AKVNLKZNZBPOAT-QKFKETGDSA-N
Formula
C27H27N3O6S
Mass
521.59
Taxonomic Classification
Taxonomy Tree
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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 Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Lactams Cyclic ketones Oxacyclic compounds Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Coumaran - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Monocyclic benzene moiety - Pyrrole - Thiadiazole - Tertiary carboxylic acid amide - Azole - Vinylogous acid - Heteroaromatic compound - Cyclic ketone - Tertiary amine - Amino acid or derivatives - Ketone - Carboxamide group - Lactam - Oxacycle - Carboxylic acid derivative - Enol - Ether - Azacycle - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - 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