Compound Identification
SMILES
Cl.CC(=O)NCC(=O)N1CC[C@H](NCC2=C(OC3CC3)C=CC(=C2)N2N=NN=C2C(F)(F)F)[C@@H](C1)C1=CC=CC=C1
InChIKey
InChIKey=ZQKODDCBCBLGFC-SJEIDVEUSA-N
Formula
C27H31ClF3N7O3
Mass
594.04
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
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Phenylpiperidines Phenyltetrazoles and derivatives N-acylpiperidines Benzylamines Phenylmethylamines Phenoxy compounds Phenol ethers Alkyl aryl ethers Aminopiperidines Aralkylamines Heteroaromatic compounds Acetamides Tertiary carboxylic acid amides Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Hydrochlorides Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylpiperidine - Phenyltetrazole - N-acyl-piperidine - Phenoxy compound - Phenol ether - Phenylmethylamine - Benzylamine - Alkyl aryl ether - 4-aminopiperidine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Secondary amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available