Compound Identification
SMILES
CC(CC(CC1=CC=CC=C1)C(O)=O)OC(=O)C(CO)NCB=O
InChIKey
InChIKey=KWISURJUKOLMAE-UHFFFAOYSA-N
Formula
C16H22BNO6
Mass
335.16
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
Serine and derivatives Phenylpropanoic acids Beta hydroxy acids and derivatives Dicarboxylic acids and derivatives Benzene and substituted derivatives Carboxylic acid esters Amino acids Organic metalloid salts Dialkylamines Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkylboranes
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-amino acid ester - Serine or derivatives - 3-phenylpropanoic-acid - Beta-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Hydroxy acid - Carboxylic acid ester - Amino acid - Carboxylic acid - Organic metalloid salt - Secondary amine - Secondary aliphatic amine - Alcohol - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alkylborane - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic homomonocyclic 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