Compound Identification
SMILES
[Na+].[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C/C1=NN2CC3=CC=CC=C3OCC2=C1
InChIKey
InChIKey=PEAVLVMCIXPBBT-IBKPVJBUSA-M
Formula
C18H12N3NaO4S
Mass
389.36
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
Thiazolecarboxylic acids and derivatives Penems Alkyl aryl ethers Vinylogous thioesters Benzenoids Thiazolines Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Azetidines Thioenol ethers Carboxylic acid salts Monocarboxylic acids and derivatives Oxacyclic compounds Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic sodium salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Thiazolecarboxylic acid or derivatives - Penem - Alkyl aryl ether - Benzenoid - Vinylogous thioester - Thiazole - Meta-thiazoline - Tertiary carboxylic acid amide - Azole - Pyrazole - Beta-lactam - Heteroaromatic compound - Azetidine - Lactam - Thioenolether - Carboxylic acid salt - Carboxamide group - Oxacycle - Azacycle - Organic alkali metal salt - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hemithioaminal - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic salt - Organic zwitterion - Organic oxygen compound - 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