Compound Identification
SMILES
COC[C@@H]1NC(=O)CC\C=C/CN(C2=CC=C(OC)C=C2)C(=O)[C@H]2N(CCCCO)C(=O)[C@@H]3[C@H]([C@@H]4O[C@]23C=C4Br)C(=O)O[C@H]1C1=CC=CC=C1
InChIKey
InChIKey=BWRCYXILOFSCHK-AXDJOLIMSA-N
Formula
C37H42BrN3O9
Mass
752.659
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 Methoxyanilines Anisoles Furopyrroles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Dihydrofurans Furans Pyrroles Oxolanes Lactones Lactams Secondary carboxylic acid amides Carboxylic acid esters Alkanolamines Vinyl bromides Dialkyl ethers Bromoalkenes Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolide - Macrolactam - Alpha-amino acid or derivatives - Isoindolone - Isoindole or derivatives - Isoindoline - Methoxyaniline - Phenoxy compound - Phenol ether - Anisole - Furopyrrole - Methoxybenzene - Alkyl aryl ether - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Oxolane - Dihydrofuran - Furan - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Lactone - Carboxylic acid ester - Lactam - Carboxamide group - Secondary carboxylic acid amide - Alkanolamine - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Bromoalkene - Ether - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic nitrogen compound - Organic oxygen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxide - 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