Compound Identification
SMILES
OCC1C2CN3C(=O)C(=CC=C3C(N2)C1C(=O)NCC1CCCCC1)C1=CN=CN=C1
InChIKey
InChIKey=CMFJQPXRJRRAOF-UHFFFAOYSA-N
Formula
C23H29N5O3
Mass
423.517
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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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
Pyrrolidinecarboxamides Pyridinones Aralkylamines Azepines Pyrimidines and pyrimidine derivatives 1,3-aminoalcohols Heteroaromatic compounds Secondary carboxylic acid amides Lactams Dialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - Azepine - Pyridinone - Aralkylamine - Pyridine - Pyrimidine - Pyrrolidine - Heteroaromatic compound - 1,3-aminoalcohol - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Secondary amine - Azacycle - Secondary aliphatic amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organopnictogen compound - Alcohol - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Aromatic heteropolycyclic 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