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CHEBI:31370 - cefmenoxime hydrochloride

ChEBI IDCHEBI:31370
ChEBI Namecefmenoxime hydrochloride
Stars
DefinitionThe hemihydrochloride salt of cefmenoxime.
Last Modified6 May 2010
DownloadsMolfile
FormulaH.2C16H17N9O5S3.Cl
Net Charge0
Average Mass1059.603
Monoisotopic Mass1058.07963
SMILES[Cl-].[H+].[H][C@]12SCC(CSc3nnnn3C)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC)c1csc(N)n1.[H][C@]12SCC(CSc3nnnn3C)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC)c1csc(N)n1
InChIInChI=1S/2C16H17N9O5S3.ClH/c2*1-24-16(20-22-23-24)33-4-6-3-31-13-9(12(27)25(13)10(6)14(28)29)19-11(26)8(21-30-2)7-5-32-15(17)18-7;/h2*5,9,13H,3-4H2,1-2H3,(H2,17,18)(H,19,26)(H,28,29);1H/b2*21-8-;/t2*9-,13-;/m11./s1
InChIKeyMPTNDTIREFCQLK-UNVJPQNDSA-N
ChEBI Ontology
Outgoing Relation(s)
cefmenoxime hydrochloride (CHEBI:31370) has part cefmenoxime (CHEBI:55490)
cefmenoxime hydrochloride (CHEBI:31370) is a hydrochloride (CHEBI:36807)
IUPAC Names 
(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrochloride (2:1)
7β-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydropenam-4-carboxylic acid hydrochloride (2:1)
Synonyms  Source
CMXKEGG DRUG
Cefmenoxime HClChemIDplus
Cefmenoxime hemihydrochlorideChemIDplus
Manual XrefsDatabases
D01739KEGG DRUG
Registry NumbersSources
Beilstein:5710303Beilstein
CAS:75738-58-8KEGG DRUG
CAS:75738-58-8ChemIDplus