Structure Information
Structure

Compound Identification

SMILES

CCC(C)(C)[C@H](NC(=O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)C(NC(=O)[C@@H](C)NC=O)C(O)C1=CC=C(Br)C=C1)C(C)(C)C)C(=O)N[C@H](CC1=CNC2=CC=CC=C12)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CS(O)(=O)=O)C(=O)N[C@H]1[C@@H](C)OC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@H](CCC(N)=O)N(C)C1=O)C(C)C

InChIKey

InChIKey=GUGALNGMVNRENE-DPOFQXJLSA-N

Formula

C75H109BrN18O22S

Mass

1726.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Peptidomimetics

Subclass

Depsipeptides

Intermediate Tree Nodes

Not available

Direct Parent

Cyclic depsipeptides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclic depsipeptide - Isoleucine or derivatives - Macrolide lactam - Alpha-amino acid ester - Valine or derivatives - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Macrolactam - Alpha-amino acid amide - N-formyl-alpha amino acid or derivatives - N-formyl-alpha-amino acid - Triptan - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Pyrrolidine-2-carboxamide - Bromobenzene - Halobenzene - Aryl bromide - N-acyl-amine - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Fatty amide - Dicarboxylic acid or derivatives - Fatty acyl - Heteroaromatic compound - Alkanesulfonic acid - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Pyrrolidine - Secondary carboxylic acid amide - Primary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Guanidine - Lactone - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclic depsipeptides. These are natural or synthetic compounds having sequences of amino and hydroxy carboxylic acid residues (usually α-amino and α-hydroxy acids) connected in a ring. The residues are commonly but not necessarily regularly alternating.

External Descriptors

CHEBI:66388 : organosulfonic acid - cyclodepsipeptide

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