Compound Identification
SMILES
C1CCNCC1.CCN1\C(OC2=CC=CC=C12)=C/C=C1/N(CC(O)=O)C(=S)SC1=O
InChIKey
InChIKey=KACOAVVFWILRGM-DUXNLTLZSA-N
Formula
C21H25N3O4S2
Mass
447.57
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Benzoxazolines Thiazolidinethiones Piperidines Benzenoids Ketene acetals Thiocarboxylic acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organosulfur compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Benzoxazoline - Piperidine - Thiazolidinethione - Benzenoid - Thiazolidine - Ketene acetal or derivatives - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Oxacycle - Azacycle - Thiocarboxylic acid or derivatives - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available