Compound Identification
SMILES
COC1=C(C)C2=C(C=C1)C(O[C@@H]1C[C@@H]3N(C1)C(=O)[C@@H](C)OCCCC\C=C/[C@@H]1C[C@]1(NC3=O)C(=O)NS(=O)(=O)C1CC1)=CC(=N2)C1=NC(C)=CS1
InChIKey
InChIKey=KHLKPXRVVYOVBT-IAFXFNPWSA-N
Formula
C36H43N5O8S2
Mass
737.89
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
Alpha amino acid amides Quinolines and derivatives Anisoles 2,4-disubstituted thiazoles Alkyl aryl ethers Pyridines and derivatives Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Pyrrolidines Organosulfonic acids and derivatives Heteroaromatic compounds Aminosulfonyl compounds Tertiary amines Secondary carboxylic acid amides Lactams Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Alpha-amino acid amide - Alpha-amino acid or derivatives - Quinoline - Anisole - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Pyridine - Heteroaromatic compound - Azole - Aminosulfonyl compound - Pyrrolidine - Thiazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ether - Dialkyl ether - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur 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