Compound Identification
SMILES
CCCC(NC(=O)NS(=O)(=O)N1N=C(N(CCCS(C)(=O)=O)C1=O)C1=CC(=O)C(O)=CN1)C(NC(=O)C(=NOC(C)(C)C(O)=O)C1=CSC(N)=N1)C(O)=O
InChIKey
InChIKey=LQUDCJXUJMHLDU-UHFFFAOYSA-N
Formula
C27H36N10O14S3
Mass
820.82
Taxonomic Classification
Taxonomy Tree
-
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
-
Level 6
Alpha amino acids and derivatives
-
Level 7
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Pyridyl-1,2,4-triazoles Aryl 1,2,4-triazolones Medium-chain fatty acids Hydroxypyridines Hydroxy fatty acids Heterocyclic fatty acids Dihydropyridines Branched fatty acids 2,4-disubstituted thiazoles Dicarboxylic acids and derivatives 2-amino-1,3-thiazoles Vinylogous amides Sulfones Heteroaromatic compounds Secondary carboxylic acid amides Organic carbonic acids and derivatives Cyclic ketones Amino acids Carboxylic acids Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha-amino acid - Aryl 1,2,4-triazol-3-one - Pyridyl-1,2,4-triazole - Pyridyltriazole - Medium-chain fatty acid - Hydroxypyridine - Hydroxy fatty acid - Heterocyclic fatty acid - Dihydropyridine - Branched fatty acid - 2,4-disubstituted 1,3-thiazole - 1,3-thiazol-2-amine - Fatty acyl - Fatty acid - Pyridine - Hydropyridine - Dicarboxylic acid or derivatives - Heteroaromatic compound - Vinylogous amide - 1,2,4-triazole - Triazole - Thiazole - Sulfonyl - Sulfone - Azole - Amino acid - Cyclic ketone - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available