Compound Identification
SMILES
COC(=O)[C@@H](NP(=O)(OC[C@H]1O[C@H](C=C1)N1C=C(C)C(=O)NC1=O)OCC(Cl)(Cl)Cl)C(C)C
InChIKey
InChIKey=ISMVORNTRHTEKI-PHKAPNDASA-N
Formula
C18H25Cl3N3O8P
Mass
548.73
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
Valine and derivatives Nucleoside and nucleotide analogues Phosphoric diester monoamides Fatty acid esters Pyrimidones Hydropyrimidines Organic phosphoramides Dihydrofurans Vinylogous amides Heteroaromatic compounds Methyl esters Lactams Ureas Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Alkyl chlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Valine or derivatives - Phosphoric diester monoamide - Fatty acid ester - Pyrimidone - Hydropyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Organic phosphoric acid amide - Fatty acyl - Vinylogous amide - Heteroaromatic compound - Methyl ester - Dihydrofuran - Urea - Carboxylic acid ester - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Alkyl halide - Organohalogen compound - Organochloride - Organonitrogen compound - Alkyl chloride - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Aromatic heteromonocyclic 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