Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](NC(=O)C1(CCC(F)(F)CC1)\C=C\C1=CC2=C(C=C1)C=CC(=N2)[C@@H](C)N[S@](=O)C(C)(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H](N1)C(=O)OCC(Cl)(Cl)Cl

InChIKey

InChIKey=XEQUTJQXWQFTLZ-MKFBFCPVSA-N

Formula

C39H53Cl3F2N6O6S

Mass

878.3

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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

Peptides

Direct Parent

Dipeptides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-dipeptide - Alpha-amino acid ester - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Quinoline - Styrene - Cyclohexyl halide - 1,2-diazinane - Fatty acyl - N-acyl-amine - Benzenoid - Fatty amide - Pyridine - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Carboxylic acid hydrazide - Aminosulfinyl compound - Sulfinic acid derivative - Secondary carboxylic acid amide - Sulfinic acid amide - Sulfinyl compound - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Alkyl chloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organofluoride - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

External Descriptors

Not available

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