Compound Identification
SMILES
C[C@@H]1CNC(=O)CC\C=C/CN(C2=CC=C(Cl)C=C2)C(=O)[C@@H]2N([C@H](CO)C3=CC=CC=C3)C(=O)[C@H]3[C@@H]([C@H]4O[C@@]23C=C4Br)C(=O)O1
InChIKey
InChIKey=VDVRTDDUHIXHAT-HMYMNQTGSA-N
Formula
C33H33BrClN3O7
Mass
699.0
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 Chlorobenzenes N-alkylpyrrolidines Pyrrolidine-2-ones Aryl chlorides Pyrroles Dihydrofurans Furans Oxolanes Tertiary carboxylic acid amides Lactones Lactams Secondary carboxylic acid amides Carboxylic acid esters Vinyl bromides Azacyclic compounds Bromoalkenes Oxacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Macrolide - Alpha-amino acid or derivatives - Isoindolone - Isoindoline - Isoindole or derivatives - Furopyrrole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - Dihydrofuran - Furan - Tertiary carboxylic acid amide - Oxolane - Pyrrole - Pyrrolidine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Monocarboxylic acid or derivatives - Vinyl bromide - Carboxylic acid derivative - Oxacycle - Vinyl halide - Organoheterocyclic compound - Haloalkene - Bromoalkene - Azacycle - Dialkyl ether - Ether - Organonitrogen compound - Alcohol - Organic nitrogen compound - Primary alcohol - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organohalogen compound - Organobromide - Organochloride - 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