Compound Identification
SMILES
CC(C)C(NC(=O)C1=CC2=CC=CC=C2O1)C(=O)NC1CCCN(CC1=O)S(=O)(=O)C1=NC=NN1
InChIKey
InChIKey=PGFGOHFIQMFMBQ-UHFFFAOYSA-N
Formula
C22H26N6O6S
Mass
502.55
Taxonomic Classification
Taxonomy Tree
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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
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Valine and derivatives Alpha amino acid amides Benzofurans 2-heteroaryl carboxamides Furoic acid and derivatives Azepanes Benzenoids Organosulfonamides N-acyl amines Heteroaromatic compounds Sulfonyls Triazoles Cyclic ketones Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzofuran - 2-heteroaryl carboxamide - Furoic acid or derivatives - Azepane - Fatty amide - N-acyl-amine - Organosulfonic acid amide - Fatty acyl - Benzenoid - Azole - Furan - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - 1,2,4-triazole - Secondary carboxylic acid amide - Ketone - Carboxamide group - Cyclic ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available