Compound Identification
SMILES
CC(NC(=O)COC1=CC=CC=C1)C(=O)OCC(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=KXGMWZMZWBGITP-UHFFFAOYSA-N
Formula
C21H19NO6
Mass
381.384
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
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid esters Alanine and derivatives Benzofurans Phenoxy compounds Phenol ethers Aryl alkyl ketones Alkyl aryl ethers Alpha-acyloxy ketones Heteroaromatic compounds Furans Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alanine or derivatives - Benzofuran - Phenoxy compound - Phenol ether - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Alpha-acyloxy ketone - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Oxacycle - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available