Compound Identification
SMILES
CC1=CC(CN2C(=O)C(NCCC3=CC=C(OS(C)(=O)=O)C=C3)=C(C3=CC=CC=C3)S2(=O)=O)=NO1
InChIKey
InChIKey=PODKWHPJPBGBCI-UHFFFAOYSA-N
Formula
C23H23N3O7S2
Mass
517.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
Phenethylamines Phenoxy compounds Aralkylamines Organosulfonic acid esters Sulfonic acid esters Thiazolines Heteroaromatic compounds Isoxazoles Methanesulfonates Sulfonyls Azacyclic compounds Dialkylamines Enamines Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Phenethylamine - Phenoxy compound - Aralkylamine - Monocyclic benzene moiety - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Azole - Isoxazole - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Ortho-thiazoline - Secondary amine - Secondary aliphatic amine - Enamine - Oxacycle - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - 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