Compound Identification
SMILES
NC1=NC(=CS1)C(=N\O)\C(=O)N[C@H]1[C@H]2CCC(SCSC3=NNN=C3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=DXYZDPILTOQHGF-ZQZATUIBSA-N
Formula
C16H16N8O5S3
Mass
496.54
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
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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
N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles Tetrahydropyridines Alkylarylthioethers Vinylogous thioesters 2-amino-1,3-thiazoles Triazoles Tertiary carboxylic acid amides Dithioacetals Heteroaromatic compounds Ketoximes Thioenol ethers Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acids Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Tetrahydropyridine - 1,3-thiazol-2-amine - Vinylogous thioester - Azole - Thioacetal - Heteroaromatic compound - Ketoxime - 1,2,3-triazole - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Thioenolether - Thioether - Sulfenyl compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Amine - Organic oxide - Organosulfur compound - Organonitrogen compound - Primary amine - Organooxygen 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