Compound Identification
SMILES
COC1=CC=C(C=C1)N1C\C=C/CCC(=O)N[C@H](C)[C@H](OC(=O)[C@@H]2[C@H]3O[C@]4(C=C3Br)[C@H]2C(=O)N([C@H](CO)C2=CC=CC=C2)[C@H]4C1=O)C1=CC=CC=C1
InChIKey
InChIKey=KUDBTRXKTAYXIG-PEODJCDLSA-N
Formula
C40H40BrN3O8
Mass
770.677
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 Bromoalkenes Azacyclic compounds Vinyl bromides Dialkyl ethers Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Macrolide - Alpha-amino acid or derivatives - Isoindolone - Isoindoline - Methoxyaniline - Isoindole or derivatives - Phenoxy compound - Anisole - Phenol ether - Furopyrrole - Methoxybenzene - Alkyl aryl ether - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Dihydrofuran - Furan - Oxolane - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Vinyl bromide - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Monocarboxylic acid or derivatives - Alcohol - Organic oxide - Organic nitrogen compound - Primary alcohol - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - 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