Compound Identification
SMILES
CCOC1=C(OCC)C=C(NCCNC(=O)C(NC(C2=CC=C(C=C2)C2=CC=C(C=C2)S(C)(=O)=O)C(F)(F)F)C(C)(C)F)C=C1
InChIKey
InChIKey=YKIXCTDTSJVBOD-UHFFFAOYSA-N
Formula
C32H39F4N3O5S
Mass
653.73
Taxonomic Classification
Taxonomy Tree
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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
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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
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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
Alpha amino acid amides Biphenyls and derivatives Aminophenyl ethers Benzenesulfonyl compounds Phenylalkylamines Phenoxy compounds Nitrogen mustard compounds Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers N-acyl amines Sulfones Secondary carboxylic acid amides Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Biphenyl - Aminophenyl ether - Benzenesulfonyl group - Phenoxy compound - Nitrogen mustard - Phenylalkylamine - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Fatty acyl - Fatty amide - N-acyl-amine - Benzenoid - Sulfone - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Secondary aliphatic amine - Ether - Secondary amine - Organooxygen compound - Organosulfur compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Alkyl halide - Organonitrogen compound - Aromatic homomonocyclic 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