ClassyFire

Compound Identification

SMILES

CCOC(=O)[C@](C)(S)[C@@H](N)CC(C)C

InChIKey

InChIKey=IOWMSRHIXCBYNZ-WCBMZHEXSA-N

Formula

C10H21NO2S

Mass

219.34

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 Beta amino 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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Fatty acid esters Carboxylic acid esters Monocarboxylic acids and derivatives Alkylthiols Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aliphatic acyclic compounds

Substituents

Beta amino acid or derivatives - Fatty acid ester - Fatty acyl - Carboxylic acid ester - Alkylthiol - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary amine - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

Export to: