Compound Identification
SMILES
[Na+].[O-]S(=O)(=O)C1=CC=C(NC(=S)C2SC(=S)N(C2=O)C2=CC=CC(=C2)C(F)(F)F)O1
InChIKey
InChIKey=ASNWODZWBDMNSO-UHFFFAOYSA-M
Formula
C15H8F3N2NaO5S4
Mass
504.46
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 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
Trifluoromethylbenzenes Arylsulfonic acids and derivatives Thiazolidinethiones Furans Thioamides Heteroaromatic compounds Sulfonyls Organosulfonic acids Tertiary amines Organic metal halides Azacyclic compounds Thiocarboxylic acid amides Oxacyclic compounds Organofluorides Organic sodium salts Organic oxides Hydrocarbon derivatives Alkyl fluorides Thiocarbonyl compounds Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Trifluoromethylbenzene - Arylsulfonic acid or derivatives - Monocyclic benzene moiety - Thiazolidinethione - Benzenoid - Thiazolidine - Thioamide - Sulfonyl - Organosulfonic acid - Furan - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Tertiary amine - Thiocarboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Oxacycle - Organic metal halide - Alkyl fluoride - Alkyl halide - Thiocarbonyl group - Organic salt - Organic sodium salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organic cation - Aromatic heteromonocyclic 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