Compound Identification
SMILES
COC1=CC=C(C=C1)N1CC=C[C@]23O[C@@H]4\C=C/CCC(=O)OC[C@H](NC(=O)[C@@H]4[C@H]2C(=O)N(CCCCO)[C@@H]3C1=O)C1=CC=CC=C1
InChIKey
InChIKey=VHJITSJXBNTPOY-NXCZBZKVSA-N
Formula
C35H39N3O8
Mass
629.71
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 Methoxyanilines Anisoles Phenoxy compounds Furopyrroles Methoxybenzenes Alkyl aryl ethers Azepines Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Pyrroles Furans Oxolanes Lactams Secondary carboxylic acid amides Carboxylic acid esters Lactones Alkanolamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolide - Macrolactam - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Furopyrrole - Alkyl aryl ether - Azepine - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - N-alkylpyrrolidine - Oxolane - Furan - Pyrrole - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Azacycle - Ether - Dialkyl ether - Alkanolamine - Carboxylic acid derivative - Organooxygen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organic oxygen compound - 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