Compound Identification
SMILES
[Na+].NC1=NC(=CS1)C(=N/OCCF)\C(=O)N[C@H]1[C@H]2CCC(SC3=NC(=CS3)C(=O)OCC3=CC=CC=C3)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=KWTLOEKAUHNAKQ-RXMNJLRESA-M
Formula
C26H22FN6NaO7S3
Mass
668.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbacephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Not available
Direct Parent
Carbacephems
Alternative Parents
N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls Thiazolecarboxylic acids and derivatives Aryl thioethers Tetrahydropyridines 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles Vinylogous thioesters Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Thioenol ethers Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid esters Carboxylic acid salts Sulfenyl compounds Azacyclic compounds Organic metal halides Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Organic sodium salts Primary amines Carbonyl compounds Alkyl fluorides Organofluorides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Aryl thioether - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Tetrahydropyridine - Benzenoid - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Vinylogous thioester - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Thioenolether - Azetidine - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Sulfenyl compound - Organic metal halide - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carbacephems. These are a new class of beta-lactam antibiotics similar in structure to the cephalosporins. They differ from cephalosporins, however, in the substitution of a sulfur atom in the dihydrothiazine ring with a methylene group to form a tetrahydropyridine ring.
External Descriptors
Not available