Compound Identification
SMILES
CC(C)(C)OC(=O)N[C@H]1[C@H]2CCC(C3=CSC(=N3)C3=CC=C(F)C=C3)=C(N2C1=O)C(=O)OCC=C
InChIKey
InChIKey=GTDTUZHXHATAAU-MOPGFXCFSA-N
Formula
C25H26FN3O5S
Mass
499.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbacephems
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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
Not available
Direct Parent
Carbacephems
Alternative Parents
Alpha amino acids and derivatives Tetrahydropyridines 2,4-disubstituted thiazoles Fluorobenzenes Aryl fluorides Tertiary carboxylic acid amides Carbamate esters Enoate esters Heteroaromatic compounds Azetidines Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organonitrogen compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - Alpha-amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Fluorobenzene - Halobenzene - Tetrahydropyridine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Carbamic acid ester - Thiazole - Carboxylic acid ester - Carboxamide group - Azetidine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - 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