Compound Identification
SMILES
CSC=C(C(=O)NC1[C@@H]2SCC(CSC3=NN=NN3C)=C(OC(O)=O)N2C1=O)C1=CSC(N)=N1
InChIKey
InChIKey=NYFVMURYHOXJPW-SBNLOKMTSA-N
Formula
C17H18N8O5S4
Mass
542.62
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
Cephems 2,4-disubstituted thiazoles Alkylarylthioethers Vinylogous thioesters 1,3-thiazines 2-amino-1,3-thiazoles Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Carbonic acid monoesters Thioenol ethers Secondary carboxylic acid amides Ketene acetals Azetidines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Dialkylthioethers Primary amines Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Cephem - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - 1,3-thiazol-2-amine - Vinylogous thioester - Azole - Beta-lactam - Heteroaromatic compound - Carbonic acid monoester - Tertiary carboxylic acid amide - Tetrazole - Thiazole - Azetidine - Carboxamide group - Ketene acetal or derivatives - Lactam - Carbonic acid derivative - Secondary carboxylic acid amide - Thioenolether - Thioether - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Carbonyl group - Organosulfur compound - Primary amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - 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