Structure Information
Structure

Compound Identification

SMILES

CC[C@H]1NC(=O)[C@@H](NC(=O)C2=NC=CC=C2O)[C@@H](C)OC(=O)[C@@H](NC(=O)C2CC(=O)C(CS[C@@H]3CN4CCC3CC4)CN2C(=O)[C@H](CC2=CC=C(C=C2)N(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O)C1=CC=CC=C1

InChIKey

InChIKey=WTHRRGMBUAHGNI-MJWHERSYSA-N

Formula

C53H67N9O10S

Mass

1022.23

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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 - Macrolide lactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Macrolactam - Alpha-amino acid or derivatives - Pyridine carboxylic acid or derivatives - Pyridinecarboxamide - 2-heteroaryl carboxamide - Aniline or substituted anilines - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Piperidinone - Hydroxypyridine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyridine - Vinylogous acid - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Lactone - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Oxacycle - Thioether - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Amine - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - 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:8732 : cyclodepsipeptide

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