Compound Identification
SMILES
COC1=C(C)C2=C(C=C1)C(O[C@H]1C[C@@H]3N(C1)C(=O)N[C@@]1(C[C@H]1\C=C/CCCCN(C)C3=O)C(C)=O)=CC(=N2)C1=NC(=CS1)C(F)(F)F
InChIKey
InChIKey=PMDHVGWKPUBIRI-FXPBPBSLSA-N
Formula
C33H36F3N5O5S
Mass
671.74
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 acids and derivatives Quinolines and derivatives Anisoles 2,4-disubstituted thiazoles Alkyl aryl ethers Pyridines and derivatives Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Ketones Ureas Tertiary amines Lactams Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Alpha-amino acid or derivatives - Quinoline - Anisole - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Thiazole - Tertiary amine - Urea - Amino acid or derivatives - Carboxamide group - Lactam - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Amine - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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