Compound Identification
SMILES
CC(C)NC1=C(N=CC=C1)N1CCN(CC1)C(=O)C1=CC2=C(N1)C=CC(NS(C)(=O)=O)=C2.CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(N)=O)NC(=O)C1=NC2=CC=CC=C2C=C1
InChIKey
InChIKey=SREDCRGYQBBBNK-YOXDLBRISA-N
Formula
C60H78N12O8S
Mass
1127.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Asparagine and derivatives
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Level 6
Alpha amino acids and derivatives
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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
Direct Parent
Asparagine and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives Quinoline carboxamides Alpha amino acid amides Indolecarboxamides and derivatives N-arylpiperazines Pyridinylpiperazines Phenylbutylamines Sulfanilides Amphetamines and derivatives Indoles Piperidinecarboxamides Pyridinecarboxylic acids and derivatives Pyrrole carboxamides 2-heteroaryl carboxamides Dialkylarylamines Aminopyridines and derivatives Secondary alkylarylamines Aralkylamines Substituted pyrroles Organosulfonamides Organic sulfonamides N-acyl amines Imidolactams Aminosulfonyl compounds Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides 1,2-aminoalcohols Trialkylamines Secondary alcohols Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Asparagine or derivatives - N-acyl-alpha amino acid or derivatives - Quinoline-2-carboxamide - Pyridinylpiperazine - Indolecarboxylic acid derivative - Indolecarboxamide derivative - N-arylpiperazine - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Quinoline - Sulfanilide - Piperidinecarboxamide - 2-piperidinecarboxamide - Indole - Indole or derivatives - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Dialkylarylamine - Aralkylamine - Secondary aliphatic/aromatic amine - Aminopyridine - Organic sulfonic acid amide - Piperazine - Pyridine - Substituted pyrrole - Fatty acyl - Fatty amide - Piperidine - 1,4-diazinane - Monocyclic benzene moiety - Organosulfonic acid amide - Imidolactam - N-acyl-amine - Benzenoid - Heteroaromatic compound - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Primary carboxylic acid amide - Secondary alcohol - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - 1,2-aminoalcohol - Secondary amine - Organoheterocyclic compound - Azacycle - Organosulfur compound - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available