Compound Identification
SMILES
CC(C)(C)OC(=O)N1CC2CC(C=C3CCN(CC(F)(F)F)C3=O)=C(N3[C@H]2C1C3=O)C(=O)OC(C)(C)C
InChIKey
InChIKey=ALIGWHWUCRBXJB-UPTPFMHGSA-N
Formula
C25H32F3N3O6
Mass
527.541
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbacephems
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Subclass
Beta lactams
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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 Pyrrolidine carboxylic acids Tetrahydropyridines 1,4-diazepanes Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Carbamate esters Enoate esters Azetidines Azacyclic compounds Monocarboxylic acids and derivatives Alkyl fluorides Organic oxides Organonitrogen compounds Organofluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Carbacephem - Alpha-amino acid or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1,4-diazepane - Diazepane - Tetrahydropyridine - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Azetidine - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Alkyl halide - Organonitrogen compound - Organooxygen compound - Aliphatic 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