Structure Information
Structure

Compound Identification

SMILES

CCS(=O)(=O)N(CC1=CC(COC2=CC=C(C=C2)C2=CC(F)=C(F)C=C2OC)=CC=C1)C(C(N(CC1=CC(COC2=CC=C(C=C2)C2=CC(F)=C(F)C=C2OC)=CC=C1)C(=O)C(C)(C)C)C(O)=O)C(O)=O

InChIKey

InChIKey=BTRBCJHIAUSKHD-UHFFFAOYSA-N

Formula

C53H52F4N2O11S

Mass

1001.06

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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

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Aspartic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Biphenyl - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Organic sulfonic acid amide - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid - Ether - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid 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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