Compound Identification
SMILES
OC(C(=O)NC1[C@@H]2SCC(CSC3=NN4N=NN=C4C=C3)=C(N2C1=O)C(O)=O)C1=CC=CC=C1F
InChIKey
InChIKey=MTJBGHGVOYVUIA-KJXMEXGPSA-N
Formula
C20H16FN7O5S2
Mass
517.51
Taxonomic Classification
Taxonomy Tree
-
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
-
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 Phenylacetamides Alkylarylthioethers Fluorobenzenes 1,3-thiazines Pyridazines and derivatives Aryl fluorides Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Azetidines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Carbonyl compounds Organonitrogen compounds Aromatic alcohols Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Aryl thioether - Halobenzene - Alkylarylthioether - Fluorobenzene - Meta-thiazine - Aryl fluoride - Aryl halide - Pyridazine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Tetrazole - Secondary carboxylic acid amide - Azetidine - Secondary alcohol - Carboxamide group - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Aromatic alcohol - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Alcohol - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - 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