Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C1=CC=CC=C1C(=O)OCC1=C(N2[C@@H](SC1)[C@H](NC(=O)CCCC(NC(=O)C1=CC=CC=C1)C(O)=O)C2=O)C(O)=O
InChIKey
InChIKey=KUEIAQKOBGQVGP-DFEMSUKISA-N
Formula
C36H34N4O12S2
Mass
778.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
-
Level 5
Cephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
Hippuric acids N-acyl-alpha amino acids Tosyl compounds Benzenesulfonamides Benzoic acid esters Benzenesulfonyl compounds Benzoyl derivatives Medium-chain fatty acids Heterocyclic fatty acids N-acyl amines 1,3-thiazines Dicarboxylic acids and derivatives Aminosulfonyl compounds Tertiary carboxylic acid amides Organosulfonic acids and derivatives Azetidines Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Hydrocarbon derivatives Organic oxides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzoate ester - Tosyl compound - Benzamide - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoyl - Medium-chain fatty acid - Heterocyclic fatty acid - Toluene - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Meta-thiazine - Benzenoid - N-acyl-amine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azetidine - Azacycle - Dialkylthioether - Carboxylic acid - Thioether - Carboxylic acid derivative - Hemithioaminal - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available