Compound Identification
SMILES
COC(=O)[C@H](C[C@@H]1[C@@H](N(C2=CC=CC=C12)S(=O)(=O)C1=CC=C(C)C=C1)C1=C(C[C@H](NC(C)=O)C(=O)OC)C2=CC=CC=C2N1)NC(C)=O
InChIKey
InChIKey=HKHUJJCFVKYIIH-KZKJCWMJSA-N
Formula
C35H38N4O8S
Mass
674.77
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
N,N-disubstituted p-toluenesulfonamides Alpha amino acid esters Indolyl carboxylic acids and derivatives 3-alkylindoles Benzenesulfonamides Benzenesulfonyl compounds Fatty acid esters Substituted pyrroles Organosulfonamides Dicarboxylic acids and derivatives Sulfonyls Acetamides Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N,n-disubstituted p-toluenesulfonamide - N-acyl-alpha amino acid or derivatives - Indolyl carboxylic acid derivative - P-toluenesulfonamide - Tosyl compound - Benzenesulfonamide - 3-alkylindole - Benzenesulfonyl group - Indole or derivatives - Indole - Fatty acid ester - Toluene - Benzenoid - Dicarboxylic acid or derivatives - Organosulfonic acid amide - Monocyclic benzene moiety - Fatty acyl - Substituted pyrrole - Heteroaromatic compound - Acetamide - Methyl ester - Pyrrole - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur 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