Compound Identification
SMILES
CCOC(=O)[C@H]1CCC[NH+](CC2=NC3=C(C(=C(C)S3)C3=CC=C(C)C=C3)C(=O)N2)C1
InChIKey
InChIKey=RKNAYQKNFATWBS-KRWDZBQOSA-O
Formula
C23H28N3O3S
Mass
426.55
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
Delta amino acids and derivatives
Alternative Parents
Piperidinecarboxylic acids Thienopyrimidines Aralkylamines Toluenes Pyrimidones Heteroaromatic compounds Thiophenes Quaternary ammonium salts Lactams Trialkylamines Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Delta amino acid or derivatives - Thienopyrimidine - Piperidinecarboxylic acid - Pyrimidone - Toluene - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrimidine - Quaternary ammonium salt - Thiophene - Heteroaromatic compound - Lactam - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available