Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)C1=C(N2N(CCC(N)(CC3=CC=C(F)C=C3)C2=O)C1C1=CC=CC=C1)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(O)C(=O)NCC1=CC=C(C=C1)C(N)=O
InChIKey
InChIKey=NUQDGEGIZRIMJW-VUQJAJNWSA-N
Formula
C48H56FN7O9S
Mass
926.07
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
Tosyl compounds Alpha amino acids and derivatives Benzamides Benzenesulfonyl compounds Benzoyl derivatives Aralkylamines Fluorobenzenes Pyridazines and derivatives Aryl fluorides N-acyl amines Monosaccharides Diazinanes Sulfones Pyrazolines Carbamate esters Secondary carboxylic acid amides Secondary alcohols Primary carboxylic acid amides Carboxylic acid hydrazides Azacyclic compounds Organic oxides Organofluorides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Alpha-amino acid or derivatives - Tosyl compound - Benzenesulfonyl group - Benzamide - Benzoic acid or derivatives - Benzoyl - Fluorobenzene - Halobenzene - Toluene - Aralkylamine - Fatty amide - 1,2-diazinane - Benzenoid - Pyridazine - Fatty acyl - Monocyclic benzene moiety - Monosaccharide - Aryl halide - Aryl fluoride - N-acyl-amine - Carbamic acid ester - Sulfonyl - Sulfone - Pyrazoline - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid hydrazide - Carboxamide group - Primary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Alcohol - Primary aliphatic amine - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - 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