Compound Identification
SMILES
CC(C)(C)NC(=O)[C@@H]1C[C@@H](CCN1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(N)=O)NC(=O)OCC1=CC=CC=C1)SC1=CC=CC=C1
InChIKey
InChIKey=MAABPPCRRDNNSY-ISBPOBPSSA-N
Formula
C38H49N5O6S
Mass
703.9
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
-
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
Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Benzyloxycarbonyls Piperidinecarboxamides Thiophenol ethers Alkylarylthioethers Aralkylamines N-acyl amines Carbamate esters 1,2-aminoalcohols Trialkylamines Secondary carboxylic acid amides Secondary alcohols Primary carboxylic acid amides Organic carbonic acids and derivatives Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Benzyloxycarbonyl - Piperidinecarboxamide - 2-piperidinecarboxamide - Aryl thioether - Thiophenol ether - Aralkylamine - Alkylarylthioether - N-acyl-amine - Fatty acyl - Benzenoid - Piperidine - Fatty amide - Monocyclic benzene moiety - Carbamic acid ester - 1,2-aminoalcohol - Carboxamide group - Carbonic acid derivative - Tertiary aliphatic amine - Primary carboxylic acid amide - Secondary alcohol - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteromonocyclic 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