Compound Identification
SMILES
COC(=O)[C@@H]1[C@@H](C(C)C)N1[S@@](=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=VZDFNYPQZQITNT-RJXZABEZSA-N
Formula
C14H19NO3S
Mass
281.37
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
Toluenes Aziridinecarboxylic acids Methyl esters Sulfinic acids and derivatives Sulfinyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Toluene - Aziridinecarboxylic acid - Monocyclic benzene moiety - Benzenoid - Methyl ester - Carboxylic acid ester - Sulfinic acid derivative - Aziridine - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - 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