Compound Identification
SMILES
CCOC(=O)C(N)C(=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=YQAKSUTUAIGMII-UHFFFAOYSA-N
Formula
C12H13NO5
Mass
251.238
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
Benzodioxoles Aryl alkyl ketones Beta-keto acids and derivatives Fatty acid esters 1,3-dicarbonyl compounds Benzenoids Alpha-amino ketones Carboxylic acid esters Monocarboxylic acids and derivatives Acetals Oxacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Benzodioxole - Aryl alkyl ketone - Aryl ketone - Beta-keto acid - Fatty acid ester - Fatty acyl - Keto acid - Benzenoid - 1,3-dicarbonyl compound - Alpha-aminoketone - Carboxylic acid ester - Ketone - Acetal - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Primary amine - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Amine - Primary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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