Compound Identification
SMILES
[Cl-].[Cl-].O=C(NCC1=CC=C(OCCCC2=CC=CC=C2)C=C1)[C@@H]1CSC([NH2+]1)C1=C[NH+]=CC=C1
InChIKey
InChIKey=WJFLUIRJJSIMOD-LXTUAOQPSA-N
Formula
C25H29Cl2N3O2S
Mass
506.49
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
-
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
Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyridinium derivatives Thiazolidines Quaternary ammonium salts Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Organic oxides Amines Carbonyl compounds Organic zwitterions Hydrocarbon derivatives Organic chloride salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Thiazolidine - Carboxamide group - Secondary carboxylic acid amide - Ether - Azacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Organic chloride salt - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic salt - Organic zwitterion - Organic oxide - Aromatic heteromonocyclic 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