Compound Identification
SMILES
CSCC[C@@H](N)C(O)C(=O)NCCC1=CC=CC=N1
InChIKey
InChIKey=CCMIKIMUXWEVRC-JHJMLUEUSA-N
Formula
C13H21N3O2S
Mass
283.39
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
Pyridines and derivatives N-acyl amines Monosaccharides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Sulfenyl compounds Dialkylthioethers Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Fatty amide - Monosaccharide - N-acyl-amine - Pyridine - Fatty acyl - Heteroaromatic compound - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Thioether - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Primary aliphatic amine - Alcohol - Organic oxygen compound - Primary amine - Carbonyl group - Organic nitrogen compound - Organic oxide - 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