Compound Identification
SMILES
COCCNCc1ccc2[C@@H](CCOc2c1)NC(=O)C[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1
InChIKey
InChIKey=QVLNHQZPFVQQAJ-CLJLJLNGSA-N
Formula
C28H30Cl2FN3O5S
Mass
610.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
1-benzopyrans Benzenesulfonamides Benzenesulfonyl compounds Dichlorobenzenes Alkyl aryl ethers Aralkylamines Fluorobenzenes Organosulfonamides Aryl chlorides Fatty amides Aryl fluorides Aminosulfonyl compounds Secondary carboxylic acid amides Oxacyclic compounds Dialkylamines Dialkyl ethers Hydrocarbon derivatives Organic oxides Organofluorides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Benzenesulfonamide - Chromane - Benzopyran - 1-benzopyran - Benzenesulfonyl group - 1,2-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Halobenzene - Fluorobenzene - Fatty amide - Organosulfonic acid amide - Benzenoid - Fatty acyl - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Aryl chloride - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary aliphatic amine - Dialkyl ether - Oxacycle - Ether - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available