Compound Identification
SMILES
CC[N+](C)(C\C=C\C1=C(N2C(SC1)C(NC(=O)C(=N\OCF)\C1=NSC(N)=N1)C2=O)C([O-])=O)CC(N)=O
InChIKey
InChIKey=XAKKNLNAJBNLPC-MXLTTWSDSA-N
Formula
C20H25FN8O6S2
Mass
556.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
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 Alpha amino acid amides 1,3-thiazines Heteroaromatic compounds Thiadiazoles Tetraalkylammonium salts Tertiary carboxylic acid amides Carboxylic acid salts Secondary carboxylic acid amides Azetidines Amino acids Primary carboxylic acid amides Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Organofluorides Alkyl fluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Meta-thiazine - Tetraalkylammonium salt - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiadiazole - Azole - Amino acid - Amino acid or derivatives - Carboxylic acid salt - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Azetidine - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Thioether - Hemithioaminal - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Organic zwitterion - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - 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