Compound Identification
SMILES
NC1=NC(\C(=N\O)C(=O)N[C@H]2[C@H]3SCC(\C=C/C4=CC(OCCF)=NO4)=C(N3C2=O)C(O)=O)=C(Cl)S1
InChIKey
InChIKey=HKVVTEJTIJJBDO-QRKRUAQYSA-N
Formula
C19H16ClFN6O7S2
Mass
558.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 2,4,5-trisubstituted thiazoles Alkyl aryl ethers 1,3-thiazines Aryl chlorides 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Ketoximes Isoxazoles Azetidines Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Dialkylthioethers Carboxylic acids Oxacyclic compounds Thiohemiaminal derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organochlorides Organofluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 2,4,5-trisubstituted 1,3-thiazole - Alkyl aryl ether - Meta-thiazine - Aryl halide - 1,3-thiazol-2-amine - Aryl chloride - Isoxazole - Azole - Thiazole - Tertiary carboxylic acid amide - Ketoxime - Heteroaromatic compound - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Amino acid or derivatives - Oxacycle - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Primary amine - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - 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