Compound Identification
SMILES
COC1=CC=C(C=C1)C(O)C(NC(=O)OC(C)(C)C)C(O)=O
InChIKey
InChIKey=DKLAHKISZYXPOL-UHFFFAOYSA-N
Formula
C15H21NO6
Mass
311.334
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 Phenylalanine and derivatives
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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
Phenylalanine and derivatives
Alternative Parents
Phenylpropanoic acids Phenoxy compounds Methoxybenzenes Anisoles Beta hydroxy acids and derivatives Alkyl aryl ethers Carbamate esters Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - 3-phenylpropanoic-acid - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Beta-hydroxy acid - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Carbamic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available