Compound Identification
SMILES
CC(C)C(NC(=O)C1=CC2=C(C=C1)N=C(S2)N1C=CC=C1)C(=O)NCC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=AGLFPOPHBHDAFB-UHFFFAOYSA-N
Formula
C25H24N4O4S
Mass
476.55
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
-
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 Benzodioxoles Benzothiazoles Benzenoids Substituted pyrroles N-acyl amines Heteroaromatic compounds Thiazoles Secondary carboxylic acid amides Azacyclic compounds Acetals Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzodioxole - 1,3-benzothiazole - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Substituted pyrrole - Azole - Heteroaromatic compound - Pyrrole - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Oxacycle - Acetal - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - 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