Compound Identification
SMILES
[Na+].NC1=NC(=CS1)C(=N\OCC#C)\C(=O)N[C@H]1[C@H]2SCC(CSC3=CC=CC4=NC=CN34)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=AIXYVTCIIPJAKP-QMJLZHSXSA-M
Formula
C23H18N7NaO5S3
Mass
591.61
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
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Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives Imidazo[1,2-a]pyridines Imidazopyridines 2,4-disubstituted thiazoles Alkylarylthioethers 1,3-thiazines 2-amino-1,3-thiazoles Pyridines and derivatives N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Dialkylthioethers Carboxylic acids Acetylides Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Organic zwitterions Carbonyl compounds Primary amines Hydrocarbon derivatives Organic sodium salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Imidazo[1,2-a]pyridine - Imidazopyridine - Aryl thioether - Alkylarylthioether - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Pyridine - N-substituted imidazole - 1,3-thiazol-2-amine - Thiazole - Tertiary carboxylic acid amide - Azole - Imidazole - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid salt - Amino acid - Secondary carboxylic acid amide - Sulfenyl compound - Hemithioaminal - Thioether - Dialkylthioether - Acetylide - Carboxylic acid derivative - Organic alkali metal salt - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic sodium salt - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic zwitterion - Organosulfur compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available