Compound Identification
SMILES
CS(O)(=O)=O.CC1=C(C(C)=NO1)S(=O)(=O)N[C@H](CNC(=O)C[C@@H]1CC(=NO1)C1=CC=C(C=C1)C(N)=N)C(O)=O
InChIKey
InChIKey=HGSHXKDMLCILHO-KUARMEPBSA-N
Formula
C21H28N6O10S2
Mass
588.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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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
Alpha amino acids and derivatives
Alternative Parents
Organosulfonamides Benzene and substituted derivatives Organosulfonic acids Alkanesulfonic acids Methanesulfonates Isoxazolines Isoxazoles Aminosulfonyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Azole - Isoxazole - Isoxazoline - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Aminosulfonyl compound - Alkanesulfonic acid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Amidine - Carboximidamide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid amidine - Carbonyl group - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available