Compound Identification
SMILES
OC(=O)C1=C(N2[C@H](CC1)[C@H](NC(=O)CC1=CC=CS1)C2=O)C(O)=O
InChIKey
InChIKey=XRMKABDLIVAVNW-KOLCDFICSA-N
Formula
C15H14N2O6S
Mass
350.35
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 Tetrahydropyridines Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Thiophenes Tertiary carboxylic acid amides Azetidines Amino acids Secondary carboxylic acid amides Tertiary amines Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Tetrahydropyridine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiophene - Vinylogous amide - Heteroaromatic compound - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Azetidine - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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