Structure Information
Structure

Compound Identification

SMILES

CN(C)CC[N+]1=CC=C(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N/OCCSC2=NN\C(O2)=C2/C=C(O)C(=O)C=N2)\C2=CSC(N)=N2)C3=O)C(O)=O)C=C1

InChIKey

InChIKey=HWCWECQXGYLWIM-QDPGVEIFSA-O

Formula

C31H33N10O8S4

Mass

801.91

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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 - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Dihydropyridine - Alkylarylthioether - Meta-thiazine - Hydropyridine - Pyridine - 1,3-thiazol-2-amine - Pyridinium - Heteroaromatic compound - Monothioacetal - Azole - Tertiary carboxylic acid amide - Thiazole - Azetidine - Cyclic ketone - Tertiary aliphatic amine - Ketone - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Hydrazone - Azacycle - Dialkylthioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Enol - Oxacycle - Thioether - Organic nitrogen compound - Organic oxygen compound - Imine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Organic cation - 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

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