Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C\C(O)=O.CC1=CC2=C(C=C1)N=C(N1CCN(CCO)CC1)C1=CSC=C1O2

InChIKey

InChIKey=GGCURUIXKLLMTC-WLHGVMLRSA-N

Formula

C22H25N3O6S

Mass

459.52

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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

Not available

Substituents

Macrolactam - Diaryl ether - N-alkylpiperazine - 1,4-diazinane - Dicarboxylic acid or derivatives - Piperazine - Imidolactam - Benzenoid - Heteroaromatic compound - Thiophene - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Alkanolamine - Amidine - Carboxylic acid amidine - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Alcohol - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary alcohol - Organic oxygen compound - Hydrocarbon derivative - 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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