Compound Identification
SMILES
[Na+].CC1=NN=C(SCC2=C(N3C(SC2)C(NC(=O)C2=CC=C(COC4=C(F)C=C(F)C=C4)O2)C3=O)C([O-])=O)S1
InChIKey
InChIKey=QWRORSFYIPTWPY-UHFFFAOYSA-M
Formula
C23H17F2N4NaO6S3
Mass
602.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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 Furancarboxamides 2-heteroaryl carboxamides Phenol ethers Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes 1,3-thiazines Aryl fluorides Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid salts Azetidines Azacyclic compounds Monocarboxylic acids and derivatives Organic metal halides Dialkylthioethers Oxacyclic compounds Sulfenyl compounds Carboxylic acids Thiohemiaminal derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Cephem - 2-heteroaryl carboxamide - Phenol ether - Furoic acid or derivatives - Phenoxy compound - Aryl thioether - Furancarboxamide - Alkyl aryl ether - Alkylarylthioether - Halobenzene - Fluorobenzene - Meta-thiazine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Azole - Furan - Heteroaromatic compound - Thiadiazole - Beta-lactam - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Sulfenyl compound - Oxacycle - Azacycle - Carboxylic acid - Organic alkali metal salt - Ether - Organoheterocyclic compound - Organic metal halide - Monocarboxylic acid or derivatives - Dialkylthioether - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic sodium salt - Organic zwitterion - Organic salt - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur 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