Compound Identification
SMILES
CC(C)(C)OC(=O)C1CN(C(C(O)=O)C2=CC=NC=C2)C1N
InChIKey
InChIKey=ONSFXVYQSMKKRO-UHFFFAOYSA-N
Formula
C15H21N3O4
Mass
307.35
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 Beta amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Alpha amino acids and derivatives Azetidinecarboxylic acids Pyridines and derivatives Dicarboxylic acids and derivatives Heteroaromatic compounds Tertiary amines Carboxylic acid esters Amino acids Carboxylic acids Azacyclic compounds Aminals Primary amines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Alpha-amino acid or derivatives - Azetidinecarboxylic acid - Dicarboxylic acid or derivatives - Pyridine - Heteroaromatic compound - Tertiary amine - Azetidine - Carboxylic acid ester - Amino acid - Azacycle - Organoheterocyclic compound - Aminal - Carboxylic acid - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Primary amine - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available