Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C2=C(C=C1)C(O[C@@H]1C[C@@H]3N(C1)C(=O)[C@@H](C)OCCCC\C=C/[C@@H]1C[C@]1(NC3=O)C(=O)NS(=O)(=O)C1CC1)=CC(=N2)C1=NC(=CC=C1)C(C)C

InChIKey

InChIKey=SQPNPKSBNCAINJ-FNYFSBCKSA-N

Formula

C40H49N5O8S

Mass

759.92

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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

Alpha amino acid amides Bipyridines and oligopyridines Quinolines and derivatives Anisoles Alkyl aryl ethers Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Aminosulfonyl compounds Pyrrolidines Heteroaromatic compounds Organosulfonic acids and derivatives Tertiary amines Secondary carboxylic acid amides Lactams Dialkyl ethers Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Macrolactam - Alpha-amino acid amide - Bipyridine - Alpha-amino acid or derivatives - Quinoline - Anisole - Phenol ether - Alkyl aryl ether - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Pyridine - Heteroaromatic compound - Aminosulfonyl compound - Pyrrolidine - Tertiary carboxylic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Azacycle - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Amine - 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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