Compound Identification
SMILES
COC(=O)CCCNS(=O)(=O)C1=CN=CC(=C1)C(=O)N[C@@H](CC(O)=O)C(=O)CSCC1=CC=C(F)C=C1
InChIKey
InChIKey=YBHBOMNDMDWUTK-IBGZPJMESA-N
Formula
C23H26FN3O8S2
Mass
555.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- 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
Gamma amino acids and derivatives
Alternative Parents
Beta amino acids and derivatives Pyridinesulfonamides Nicotinamides Gamma-keto acids and derivatives Fatty acid methyl esters Fluorobenzenes Dicarboxylic acids and derivatives Organosulfonamides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Methyl esters Secondary carboxylic acid amides Ketones Azacyclic compounds Carboxylic acids Dialkylthioethers Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Gamma amino acid or derivatives - Beta amino acid or derivatives - Pyridine-3-sulfonamide - Nicotinamide - Pyridine carboxylic acid or derivatives - Gamma-keto acid - Fatty acid ester - Fluorobenzene - Halobenzene - Fatty acid methyl ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Dicarboxylic acid or derivatives - Aryl fluoride - Aryl halide - Organosulfonic acid amide - Keto acid - Pyridine - Methyl ester - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Azacycle - Sulfenyl compound - Dialkylthioether - Carboxylic acid - Organoheterocyclic compound - Thioether - Organonitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organofluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
External Descriptors
Not available