Compound Identification
SMILES
CCOC(=O)CN(CCNC(=O)OC(C)(C)C)C(=O)CN1C=NC2=C1N=C(N)N=C2Cl
InChIKey
InChIKey=LRJLTODZUPQWQN-UHFFFAOYSA-N
Formula
C18H26ClN7O5
Mass
455.9
Taxonomic Classification
Taxonomy Tree
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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 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
Purines and purine derivatives Aminopyrimidines and derivatives Halopyrimidines Aryl chlorides N-substituted imidazoles Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Imidazopyrimidine - Purine - Aminopyrimidine - Halopyrimidine - Aryl chloride - N-substituted imidazole - Aryl halide - Pyrimidine - Imidazole - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Carbamic acid ester - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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