Compound Identification
SMILES
CCOC(=O)C(CC1=CNC2=CC=CC=C12)NC1CCC2=CC=CC=C2N(CC(O)=O)C1=O
InChIKey
InChIKey=NRBULABTUTWKCG-UHFFFAOYSA-N
Formula
C25H27N3O5
Mass
449.507
Taxonomic Classification
Taxonomy Tree
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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
Benzazepines 3-alkylindoles Aralkylamines Azepines Fatty acid esters Substituted pyrroles Benzenoids Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Amino acids Lactams Azacyclic compounds Carboxylic acids Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Benzazepine - 3-alkylindole - Indole or derivatives - Indole - Azepine - Fatty acid ester - Aralkylamine - Substituted pyrrole - Benzenoid - Dicarboxylic acid or derivatives - Fatty acyl - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Lactam - Carboxylic acid ester - Amino acid - Carboxamide group - Azacycle - Carboxylic acid - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen 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