Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=NN(N=C1C1=NC=CS1)[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CCCCC\C=C\[C@@H]1C[C@]1(NC2=O)C(=O)NS(=O)(=O)C1CC1)NC1=CSC=C1

InChIKey

InChIKey=QCOOINIZZDQKEO-YLFXRHPESA-N

Formula

C37H42N8O6S3

Mass

790.97

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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

Cyclic peptides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclic alpha peptide - Macrolactam - Alpha-amino acid amide - Phenyl-1,2,3-triazole - Phenyltriazole - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aminothiophene - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Thiazole - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Thiophene - Triazole - 1,2,3-triazole - Pyrrolidine - Aminosulfonyl compound - Azole - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Secondary amine - Organoheterocyclic compound - Azacycle - Ether - Organosulfur compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclic peptides. These are compounds containing a cyclic moiety bearing a peptide backbone.

External Descriptors

Not available

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