Compound Identification
SMILES
CC(C)(O\N=C(/C(=O)N[C@H]1CON(C1=O)C1(C[C@H](N2C(=O)C3=CC(O)=C(O)C=C3C2=O)C(=O)O1)C(O)=O)C1=CSC(N)=N1)C(O)=O
InChIKey
InChIKey=JIGNDUNBKKQBKB-OIANMIDYSA-N
Formula
C25H22N6O14S
Mass
662.54
Taxonomic Classification
Taxonomy Tree
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid esters Phthalimides Tricarboxylic acids and derivatives Isoindoles 1-hydroxy-2-unsubstituted benzenoids 2,4-disubstituted thiazoles Oxazolidinones 2-amino-1,3-thiazoles N-substituted carboxylic acid imides Gamma butyrolactones Oxolanes Isoxazolidines Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Carboxylic acid esters Oxacyclic compounds Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Primary amines Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Phthalimide - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Tricarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Gamma butyrolactone - Carboxylic acid imide, n-substituted - Oxazolidinone - 1,3-thiazol-2-amine - Benzenoid - Azole - Thiazole - Oxolane - Carboxylic acid imide - Heteroaromatic compound - Isoxazolidine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Amino acid - Lactone - Azacycle - Carboxylic acid - Organoheterocyclic compound - Oxacycle - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Primary amine - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxygen 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