Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)N1CCCNC(=O)C2=CC=C(NC3=NC(NCC4=CC=C(OCC1)C=C4)=NC(OCC(F)(F)F)=N3)C=C2

InChIKey

InChIKey=ITXNMURJZQTIEB-UHFFFAOYSA-N

Formula

C28H32F3N7O5

Mass

603.603

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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 - 2,4-diamine-s-triazine - Alkoxy-s-triazine - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - Secondary aliphatic/aromatic amine - Triazine - 1,3,5-triazine - Benzenoid - Heteroaromatic compound - Carbamic acid ester - Amino acid or derivatives - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Oxacycle - Organoheterocyclic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Alkyl fluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organofluoride - Amine - Organic nitrogen compound - Organonitrogen 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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