Compound Identification
SMILES
COC(=O)N[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C1=NC=C(N1)C1=CC=C(C=C1)C1=CC=C(C=C1)C1=C2COCCCCCC[C@H](NC(=O)OC)C(=O)N3CCC[C@H]3C(N2)=N1)C1CC1
InChIKey
InChIKey=AAKOSTBHWFEYQW-SZHPJKBSSA-N
Formula
C47H60N8O7
Mass
849.046
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
Valine and derivatives Alpha amino acid amides Biphenyls and derivatives Phenylimidazoles N-acylpyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Methylcarbamates Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Carbonyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Valine or derivatives - Alpha-amino acid amide - Biphenyl - 5-phenylimidazole - 4-phenylimidazole - Alpha-amino acid or derivatives - N-acylpyrrolidine - Monocyclic benzene moiety - Benzenoid - Azole - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Methylcarbamate - Imidazole - Lactam - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen 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