Compound Identification
SMILES
[Na+].[H]C(N)(CSCC([O-])=N[C@]1(OC)C(=O)N2C(C(O)=O)=C(CSC3=NN=NN3C)CS[C@]12[H])C(O)=O
InChIKey
InChIKey=SBIDXLKJYJVQOE-ZMUPEPPLSA-M
Formula
C16H20N7NaO7S3
Mass
541.55
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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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
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Class
Carboxylic acids and derivatives
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Cysteine and derivatives Alpha amino acids Cephems Alkylarylthioethers Dicarboxylic acids and derivatives 1,3-thiazines Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Amino acids Propargyl-type 1,3-dipolar organic compounds Dialkylthioethers Sulfenyl compounds Thiohemiaminal derivatives Carboxylic acids Carboximidic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organic sodium salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Alpha-amino acid - Cephem - Aryl thioether - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Tetrazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Beta-lactam - Azetidine - Amino acid - Carboxamide group - Lactam - Azacycle - Carboximidic acid - Carboximidic acid derivative - Organic alkali metal salt - Carboxylic acid - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Hemithioaminal - Sulfenyl compound - Organic salt - Hydrocarbon derivative - Organic sodium salt - Primary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available