Compound Identification
SMILES
CC(=O)N(C1[C@H]2SCC(CC[N+]3=CC=CC=C3)(CN2C1=O)C(O)=O)C1=CC=CO1
InChIKey
InChIKey=QCAXBQFLHOWSFE-KGXSXCIVSA-O
Formula
C20H22N3O5S
Mass
416.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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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
Cephams Thiazinanes Pyridinium derivatives Tertiary carboxylic acid amides Acetamides Heteroaromatic compounds Furans Azetidines Thiohemiaminal derivatives Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Cepham - Pyridine - Pyridinium - 1,3-thiazinane - Beta-lactam - Furan - Tertiary carboxylic acid amide - Heteroaromatic compound - Acetamide - Carboxamide group - Lactam - Azetidine - Hemithioaminal - Thioether - Organoheterocyclic compound - Dialkylthioether - Oxacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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