Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=NN=C(C)N1C1C[C@@H]2CC[C@H](C1)N2CC[C@H](NC(=O)C1CCC(F)(F)CC1)C1=CC=CC=C1.CC(C)[C@H](N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)COC1=C(C)C=CC=C1C)CC1=CC=CC=C1

InChIKey

InChIKey=PKEABEJERXTIOD-GVTJAGMTSA-N

Formula

C66H89F2N9O6

Mass

1142.492

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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

Valine and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Valine or derivatives - Amphetamine or derivatives - Tropane alkaloid - Phenoxy compound - Phenol ether - M-xylene - Xylene - Alkyl aryl ether - Cyclohexyl halide - Pyrimidone - Aralkylamine - Monocyclic benzene moiety - 1,3-diazinane - Fatty amide - N-acyl-amine - Piperidine - Pyrimidine - N-alkylpyrrolidine - Benzenoid - Fatty acyl - Pyrrolidine - Azole - Heteroaromatic compound - 1,2,4-triazole - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Urea - Tertiary aliphatic amine - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Alcohol - Alkyl fluoride - Alkyl halide - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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