Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CN[C@H]([C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)OCC2=CC=CC=C2)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NC2=NC3=CC=CC=C3S2)C=C1

InChIKey

InChIKey=CKXVCBLNZYVBOW-NRLRFCMXSA-N

Formula

C44H52N6O7S

Mass

809.0

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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 - N-acyl-alpha amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Benzyloxycarbonyl - Alpha-amino acid or derivatives - Amphetamine or derivatives - 1,3-benzothiazole - Benzylamine - Methoxybenzene - N-arylamide - Phenylmethylamine - Anisole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - N-acyl-amine - Heteroaromatic compound - Azole - Carbamic acid ester - Thiazole - Carboxamide group - Amino acid or derivatives - Carbonic acid derivative - Secondary carboxylic acid amide - Secondary alcohol - Organoheterocyclic compound - Azacycle - Ether - Secondary aliphatic amine - Secondary amine - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alcohol - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen 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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