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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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Level 6
Alpha amino acids and derivatives
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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
Valine and derivatives
Alternative Parents
Amphetamines and derivatives Tropane alkaloids m-Xylenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Aralkylamines Cyclohexyl halides Pyrimidones Piperidines Diazinanes N-alkylpyrrolidines N-acyl amines Triazoles Heteroaromatic compounds Ureas Trialkylamines Secondary carboxylic acid amides Secondary alcohols Azacyclic compounds Carbonyl compounds Alkyl fluorides Organofluorides Organic oxides Hydrocarbon derivatives
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