Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=C(CS[C@H]2[C@H](NC(=O)COC3=CC=CC=C3)C(=O)N12)SC=CC(=O)OCC=C

InChIKey

InChIKey=SPUBVHCTMNAQNS-XLIONFOSSA-N

Formula

C21H20N2O7S2

Mass

476.52

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems

Direct Parent

Cephalosporins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Vinylogous thioester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Acrylic acid or derivatives - Amino acid or derivatives - Azetidine - Carboxamide group - Thioenolether - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Carboxylic acid ester - Azacycle - Sulfenyl compound - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Amine - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen 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

Previous Back Next