Structure Information
Structure

Compound Identification

SMILES

NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)C1=C(OCC(=O)N2[C@H]3CC[C@@H]2CC(C3)OC2=CC=C(F)C=C2)C=CC(Cl)=C1

InChIKey

InChIKey=SYPXBEDYONTVTE-VZZNKBKWSA-N

Formula

C27H29ClFN3O6

Mass

545.99

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Proline and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Proline or derivatives - Alpha-amino acid amide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - N-acyl-piperidine - Benzoic acid or derivatives - Benzamide - Tropane alkaloid - N-acylpyrrolidine - Benzoyl - Phenoxy compound - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Chlorobenzene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Piperidine - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Primary carboxylic acid amide - Secondary alcohol - Ether - Azacycle - Organoheterocyclic compound - Alcohol - Carbonyl group - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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