Compound Identification
SMILES
COC(=O)[C@@H]1N2[C@@H]([C@H]([C@@H](C)OC(=O)OCC(Cl)(Cl)Cl)C2=O)S(=O)C1(C)C
InChIKey
InChIKey=BJIQXYLFWYIJFY-MJZVFKPVSA-N
Formula
C14H18Cl3NO7S
Mass
450.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Penams Carbonic acid diesters Thiazolidines Tertiary carboxylic acid amides Methyl esters Sulfoxides Azetidines Sulfinyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organonitrogen compounds Organopnictogen compounds Alkyl chlorides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Penam - Carbonic acid diester - Beta-lactam - Tertiary carboxylic acid amide - Thiazolidine - Methyl ester - Carbonic acid derivative - Lactam - Carboxylic acid ester - Azetidine - Carboxamide group - Sulfoxide - Monocarboxylic acid or derivatives - Azacycle - Sulfinyl compound - Organoheterocyclic compound - Alkyl chloride - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aliphatic 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