Structure Information
Structure

Compound Identification

SMILES

COC1=CN=CC(=C1)C1=CN=C(O1)C(C)(C)N1CCN(C[C@@H](O)C[C@@H](CC2=NN=C(O2)C2=CC=CC=C2)C(=O)NC2=C(O)COC3=CC=CC=C23)[C@@H](C1)C(=O)NCC(F)(F)F

InChIKey

InChIKey=FJYQUAGTBOWAAR-ZBQRRTSWSA-N

Formula

C42H45F3N8O8

Mass

846.865

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid amide - Benzopyran - 1-benzopyran - Piperazine-2-carboxamide - 2,5-disubstituted 1,3-oxazole - Alkyl aryl ether - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Fatty amide - N-acyl-amine - Piperazine - Pyridine - Benzenoid - Fatty acyl - Heteroaromatic compound - Azole - 1,3,4-oxadiazole - Oxadiazole - Oxazole - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Oxacycle - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Organic oxide - Alkyl fluoride - Alkyl halide - Amine - Organic nitrogen compound - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic 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

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