Structure Information
Structure

Compound Identification

SMILES

CC1=C(SC=N1)C1=CC=C(CNC(=O)[C@@H]2C[C@H](O)CN2C(=O)C(NC(=O)COCCOCCOCCOC2=CC=C(C=C2)C2=CC3=C(C=C2)N=CN=C3NC2=CC(Cl)=C(OCC3=CC(F)=CC=C3)C=C2)C(C)(C)C)C=C1

InChIKey

InChIKey=XZNORRXEBCTXPB-BZHVMAIXSA-N

Formula

C57H61ClFN7O9S

Mass

1074.66

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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 - Valine or derivatives - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Quinazolinamine - Diazanaphthalene - Quinazoline - Alpha-amino acid or derivatives - Phenoxy compound - Aniline or substituted anilines - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Phenol ether - N-acylpyrrolidine - Halobenzene - Fluorobenzene - Chlorobenzene - Aminopyrimidine - Alkyl aryl ether - 4,5-disubstituted 1,3-thiazole - Imidolactam - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Aryl chloride - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Carbonyl group - Amine - Alcohol - 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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