Structure Information
Structure

Compound Identification

SMILES

CC[C@H](C)[C@@H]1N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC2=CC=C(OC)C=C2)NC(=O)\C(C)=C\[C@H]2CSC(=N2)[C@@H](C)[C@@H](O)C[C@H](C)C[C@H](OC(=O)[C@@H]2CCCN2C1=O)C(C)(C)C

InChIKey

InChIKey=KXUJXPZXILTXDA-CKIYSKEDSA-N

Formula

C45H69N5O8S

Mass

840.13

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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 - Alpha-amino acid ester - Macrolactam - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Imidothiolactone - Benzenoid - Pyrrolidine - Meta-thiazoline - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Secondary alcohol - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Ether - Oxacycle - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen 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:35212 : apratoxin

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