Compound Identification
SMILES
COC(=O)N[C@@H](C(=O)N1CCC[C@H]1C1=NC=C(N1)C1=CN=C(N=C1)C1=CC=C(C=C1)C1=C(NC(=N1)[C@@H]1CCCN1C(=O)[C@H](N(C)C(O)=O)C1=CC=CC=C1)C(F)(F)F)C1=CC=CC=C1
InChIKey
InChIKey=IRFIMNYYCKRTRS-WKEQUWASSA-N
Formula
C45H43F3N10O6
Mass
876.898
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid amides
Alternative Parents
Phenylimidazoles Phenylacetamides 2,4,5-trisubstituted imidazoles N-acylpyrrolidines Pyrimidines and pyrimidine derivatives Methylcarbamates Heteroaromatic compounds Tertiary carboxylic acid amides Carbamic acids Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - 5-phenylimidazole - 4-phenylimidazole - Phenylacetamide - 2,4,5-trisubstituted-imidazole - N-acylpyrrolidine - Trisubstituted imidazole - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Carbamic acid ester - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Methylcarbamate - Imidazole - Carbamic acid - Carbamic acid derivative - Carboxamide group - Organoheterocyclic compound - Azacycle - Alkyl fluoride - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors
Not available