Compound Identification
SMILES
NC(=O)C1=C2N=C(SCC3=C(N4[C@H](SC3)[C@H](NC(=O)C(=O)C3=CSC(N)=N3)C4=O)C(O)=O)C=C(N2N=C1)C(F)(F)F
InChIKey
InChIKey=NQJDSUHYAIRRAF-ADLMAVQZSA-N
Formula
C21H15F3N8O6S3
Mass
628.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
-
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 Pyrazolo[1,5-a]pyrimidines Aryl ketones Pyrazole-4-carboxamides 2,4-disubstituted thiazoles Alkylarylthioethers Pyrimidines and pyrimidine derivatives 2-amino-1,3-thiazoles 1,3-thiazines Tertiary carboxylic acid amides Heteroaromatic compounds Vinylogous amides Secondary carboxylic acid amides Primary carboxylic acid amides Amino acids Azetidines Dialkylthioethers Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Alkyl fluorides Primary amines Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyrazolopyrimidine - Pyrazolo[1,5-a]pyrimidine - Aryl ketone - Aryl thioether - Pyrazole-4-carboxamide - Alkylarylthioether - 2,4-disubstituted 1,3-thiazole - 1,3-thiazol-2-amine - Meta-thiazine - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Pyrazole - Thiazole - Azole - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Ketone - Primary carboxylic acid amide - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Primary amine - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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