Compound Identification
SMILES
C[N+]1(C\C=C\C2=C(N3[C@H](SC2)[C@H](NC(=O)CSC2=CC=CC=C2)C3=O)C([O-])=O)CCCC1
InChIKey
InChIKey=JRNZKZVDTIJKCM-WZRDUFFMSA-N
Formula
C23H27N3O4S2
Mass
473.61
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
N-acyl-alpha amino acids and derivatives Thiophenol ethers Alkylarylthioethers 1,3-thiazines Benzene and substituted derivatives N-alkylpyrrolidines Tetraalkylammonium salts Tertiary carboxylic acid amides Secondary carboxylic acid amides Azetidines Carboxylic acid salts Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Carbonyl compounds Amines Organic salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Thiophenol ether - Alkylarylthioether - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Tetraalkylammonium salt - Pyrrolidine - Quaternary ammonium salt - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Sulfenyl compound - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic salt - Organosulfur compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - 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