Compound Identification
SMILES
COC(=O)C1COC(=O)N1C1CCN(CC1)C(=O)C1=CN=C2N(C)N=C(C)C2=C1SC(C)C
InChIKey
InChIKey=AHCHJJKULZKBLP-UHFFFAOYSA-N
Formula
C22H29N5O5S
Mass
475.56
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
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
N-acylpiperidines Pyridinecarboxylic acids and derivatives Pyrazolopyridines Alkylarylthioethers Vinylogous thioesters Oxazolidinones Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Methyl esters Pyrazoles Monocarboxylic acids and derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-piperidine - Pyrazolopyridine - Pyridine carboxylic acid or derivatives - Aryl thioether - Alkylarylthioether - Oxazolidinone - Piperidine - Pyridine - Vinylogous thioester - Heteroaromatic compound - Methyl ester - Carbamic acid ester - Tertiary carboxylic acid amide - Azole - Oxazolidine - Pyrazole - Carboxamide group - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available