Compound Identification
SMILES
O=C1[C@H]2CCN1[C@@H]1CCC3=C1C=C(OC1=C(C=CC(CN4C=NC=C4CN2)=C1)C#N)C=C3
InChIKey
InChIKey=DFXJFEAHWLUMQK-DHIUTWEWSA-N
Formula
C25H23N5O2
Mass
425.492
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Macrolactams
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Macrolactams
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Macrolactams
Alternative Parents
Diarylethers Alpha amino acids and derivatives Indanes Aralkylamines Pyrrolidine-2-ones N-substituted imidazoles N-alkylpyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkylamines Nitriles Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Diaryl ether - Alpha-amino acid or derivatives - Indane - Aralkylamine - N-substituted imidazole - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Azole - Heteroaromatic compound - Imidazole - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Lactam - Amino acid or derivatives - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Carbonyl group - Organic oxide - Organooxygen compound - Organic nitrogen compound - Amine - 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