Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1\C=C\C=C(C)\CC2=CC(N(C)C(=O)C[C@@H](OC(=O)[C@@H](C)N(C)C(=O)CCSSC3=CC=CC=N3)[C@@]3(C)O[C@H]3[C@H](C)[C@@H]3C[C@@]1(O)NC(=O)O3)=C(Cl)C(OC)=C2

InChIKey

InChIKey=LTEUSWPRMZQNEM-KXYGSRJYSA-N

Formula

C40H51ClN4O10S2

Mass

847.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Macrolactams

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Macrolactams

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Macrolactam - Alpha-amino acid ester - Alanine or derivatives - Alpha-amino acid or derivatives - Phenol ether - Anisole - Alkyl aryl ether - 1,3-oxazinane - Aryl chloride - Aryl halide - Benzenoid - Pyridine - Oxazinane - Carbamic acid ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Organic disulfide - Carboxylic acid ester - Lactam - Alkanolamine - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as macrolactams. These are cyclic amides of amino carboxylic acids, having a 1-azacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. They are nitrogen analogues (the a nitrogen atom replacing the o atom of the cyclic carboxylic acid group ) of the naturally occurring macrolides.

External Descriptors

Not available

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