Compound Identification
SMILES
C[N+]1=CC=CC=C1N1CC\C(=C\C2=C(N3C(CC2)C(NC(=O)OC(C)(C)C)C3=O)C(=O)OC(C)(C)C)C1=O
InChIKey
InChIKey=TYMDJZGYLDAMPZ-VLGSPTGOSA-O
Formula
C28H37N4O6
Mass
525.625
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 N-methylpyridinium compounds Pyrrolidine-2-ones Pyridinium derivatives Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Enoate esters Azetidines Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - Alpha-amino acid or derivatives - N-methylpyridinium - Tetrahydropyridine - Pyridine - Pyridinium - Pyrrolidone - 2-pyrrolidone - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Alpha,beta-unsaturated carboxylic ester - Carbamic acid ester - Enoate ester - Carboxylic acid ester - Azetidine - Carboxamide group - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic cation - 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