Compound Identification
SMILES
C[C@@H]1CNC(=O)CC\C=C/CN(C2=C(C)C=CC=C2Cl)C(=O)[C@@H]2N(CCCCCCO)C(=O)[C@H]3[C@@H]([C@H]4O[C@@]23C=C4Br)C(=O)O1
InChIKey
InChIKey=CRMOAUDUDBTHQY-XGSDFJDVSA-N
Formula
C32H39BrClN3O7
Mass
693.03
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
Macrolides and analogues Alpha amino acids and derivatives Isoindolones Furopyrroles Toluenes Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Pyrroles Oxolanes Dihydrofurans Furans Secondary carboxylic acid amides Carboxylic acid esters Lactams Lactones Oxacyclic compounds Dialkyl ethers Vinyl bromides Bromoalkenes Alkanolamines Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organobromides Organochlorides Primary alcohols Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolide - Macrolactam - Alpha-amino acid or derivatives - Isoindolone - Isoindole or derivatives - Isoindoline - Furopyrrole - Halobenzene - Toluene - Chlorobenzene - Pyrrolidone - 2-pyrrolidone - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Dihydrofuran - Furan - Tertiary carboxylic acid amide - Oxolane - Pyrrole - Pyrrolidine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Alkanolamine - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Monocarboxylic acid or derivatives - Vinyl bromide - Organic oxygen compound - Alcohol - Primary alcohol - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organochloride - Organonitrogen compound - Organohalogen compound - Organobromide - Organic oxide - Organic nitrogen 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