Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)SC[C@@H]1NC(=O)[C@H](CC(O)=O)CC(=O)CNC(=O)[C@H](CCCN=C(N)N)CC(=O)[C@H](CSC(C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)CSC[C@H](NC(=O)[C@H](CC2=CC=CC=C2)CC1=O)C(=O)CCCOCCOCCOCCCC(=O)COCC(=O)CCCOCCOCCOCCNC(=O)COCC(=O)NCCOCCOCCOCCNC(=O)COCC(=O)NCCOCCOCCOCCNC(=O)COCC(N)=O

InChIKey

InChIKey=JMKQKAGVCIMQTI-LRLKKJMISA-N

Formula

C100H169N15O35S3

Mass

2237.7

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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 heteromonocyclic compounds

Substituents

Macrolactam - Alpha-amino acid or derivatives - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Amino acid or derivatives - Amino acid - Carboxamide group - Guanidine - Ketone - Lactam - Cyclic ketone - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Thioether - Hydrocarbon derivative - Organic nitrogen compound - Primary aliphatic amine - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxide - Carbonyl group - Aromatic heteromonocyclic 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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