Compound Identification
SMILES
OC(=O)C1=C(Cl)CS[C@@H]2[C@H](NC(=O)COC3=C(F)C=C(F)C=C3F)C(=O)N12
InChIKey
InChIKey=UAOSTUABTNOHCO-QMTHXVAHSA-N
Formula
C15H10ClF3N2O5S
Mass
422.76
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 Phenol ethers Phenoxy compounds Alkyl aryl ethers Fluorobenzenes 1,3-thiazines Aryl fluorides Tertiary carboxylic acid amides Vinylogous halides Secondary carboxylic acid amides Azetidines Vinyl chlorides Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Chloroalkenes Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenol ether - Phenoxy compound - Alkyl aryl ether - Halobenzene - Fluorobenzene - Meta-thiazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Vinylogous halide - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Chloroalkene - Haloalkene - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Vinyl halide - Ether - Vinyl chloride - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen 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