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)NCC2=NC=CC(=O)N2)C=C1

InChIKey

InChIKey=CIMSNNWHWWXCSC-PAVKKKSZSA-N

Formula

C42H53N7O8

Mass

783.927

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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 heteromonocyclic compounds

Substituents

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