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CHEBI:31368 - cefepime hydrochloride

ChEBI IDCHEBI:31368
ChEBI Namecefepime hydrochloride
Stars
DefinitionA hydrochloride that is the monohydrate of the dihydrochloride salt of cefepime.
Last Modified18 March 2011
DownloadsMolfile
FormulaC19H25N6O5S2.Cl.H2O.HCl
Net Charge0
Average Mass571.509
Monoisotopic Mass570.08888
SMILESCl.O.[Cl-].[H][C@]12SCC(C[N+]3(C)CCCC3)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC)c1csc(N)n1
InChIInChI=1S/C19H24N6O5S2.2ClH.H2O/c1-25(5-3-4-6-25)7-10-8-31-17-13(16(27)24(17)14(10)18(28)29)22-15(26)12(23-30-2)11-9-32-19(20)21-11;;;/h9,13,17H,3-8H2,1-2H3,(H3-,20,21,22,26,28,29);2*1H;1H2/b23-12-;;;/t13-,17-;;;/m1.../s1
InChIKeyLRAJHPGSGBRUJN-OMIVUECESA-N
Roles Classification
Biological Roles:
antibacterial drug  A drug used to treat or prevent bacterial infections.
drug allergen  Any drug which causes the onset of an allergic reaction.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Applications:
antibacterial drug  A drug used to treat or prevent bacterial infections.
drug allergen  Any drug which causes the onset of an allergic reaction.
ChEBI Ontology
Outgoing Relation(s)
cefepime hydrochloride (CHEBI:31368) has part cefepime(1+) (CHEBI:59349)
cefepime hydrochloride (CHEBI:31368) has role antibacterial drug (CHEBI:36047)
cefepime hydrochloride (CHEBI:31368) is a cephalosporin (CHEBI:23066)
cefepime hydrochloride (CHEBI:31368) is a hydrate (CHEBI:35505)
cefepime hydrochloride (CHEBI:31368) is a hydrochloride (CHEBI:36807)
IUPAC Names 
1-{[(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}-1-methylpyrrolidinium chloride hydrochloride—water (1/1)
7β-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(1-methylpyrrolidinium-1-yl)methyl]-3,4-didehydrocepham-4-carboxylic acid chloride hydrochloride—water (1/1)
Synonyms  Source
Cefepime hydrochlorideKEGG COMPOUND
Cefepime dihydrochlorideKEGG COMPOUND
cefepime hydrochloride hydrateChEBI
cefepime dihydrochloride monohydrateChEBI
1-(((6R,7R)-7-(2-(2-amino-4-thiazolyl)glyoxylamido)-2-carboxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-3- yl)methyl)-1-methylpyrrolidinium chloride, 72-(Z)-(O-methyloxime) monohydrochloride monohydrateChemIDplus
cefepime HClChemIDplus
Manual XrefsDatabases
C12557KEGG COMPOUND
D01157KEGG DRUG
Registry NumbersSources
CAS:123171-59-5KEGG COMPOUND
CAS:123171-59-5ChemIDplus