Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(CN2C[C@@H](F)C[C@H]2C(O)=O)NC(=N[C@@]1(C)C1=CC=C(F)C=C1)C1=NC=CS1

InChIKey

InChIKey=LXRZSOWLURJOMV-DDVAMESESA-N

Formula

C22H22F2N4O4S

Mass

476.5

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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 heteromonocyclic compounds

Substituents

Proline or derivatives - Alpha-amino acid - L-alpha-amino acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - N-alkylpyrrolidine - Benzenoid - Hydropyrimidine - Imidolactam - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Thiazole - Methyl ester - Azole - Pyrrolidine - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Amino acid - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Amidine - Carboximidamide - Carboxylic acid amidine - Carboxylic acid - Azacycle - Enamine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Alkyl halide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Amine - Organic oxygen compound - Organic oxide - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic 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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