Cefapirin
Cefapirin Structure
Systematic / IUPAC Name: (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(4-pyridinylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
ID: Reference2733
Other Names:
7-[2-(4-Pyridylthio)acetamido]cephalosporanic acid ;
Cefa;
Cefa-ak;
Cefapirine;
Cefapirinum
; more
Formula: C17H17N3O6S2
Class: Therapeutics/Prescription Drugs Endogenous Metabolites
Spectral Data
Cefapirin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 162 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 3/17/2016 8:50:38 AM |
Identificators
| InChI | InChI=1S/C17H17N3O6S2/c1-9(21)26-6-10-7-28-16-13(15(23)20(16)14(10)17(24)25)19-12(22)8-27-11-2-4-18-5-3-11/h2-5,13,16H,6-8H2,1H3,(H,19,22)(H,24,25)/t13-,16-/m1/s1 |
| InChI Key | UQLLWWBDSUHNEB-CZUORRHYSA-N |
| Canonical SMILES | CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)O |
| CAS | |
| Splash | |
| Other Names |
7-[2-(4-Pyridylthio)acetamido]cephalosporanic acid ; Cefa; Cefa-ak; Cefapirine; Cefapirinum; Cefaprin; Cefatrex; Cephalosporanic acid, 7-[2-(4-pyridylthio)acetamido]- ; Cephapirin; Cephapirine; CEPR; (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; (6R,7R)-3-[(Acetyloxy)methyl]-8-oxo-7-{[(pyridin-4-ylthio)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; (6R,7R)-3-Acetoxymethyl-7-[(pyridin-4-ylsulfanyl)acetamido]-3,4-didehydrocepham-4-carboxylic acid; 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-{[(4-pyridinylthio)acetyl]amino}-, (6R-trans-)- ; 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-{[(4-pyridinylthio)acetyl]amino}-, (6R,7R)- |