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CHEBI:8233 - piperacillin sodium

ChEBI IDCHEBI:8233
ChEBI Namepiperacillin sodium
Stars
Last Modified13 May 2009
DownloadsMolfile
FormulaC23H26N5O7S.Na
Net Charge0
Average Mass539.546
Monoisotopic Mass539.14506
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)N1CCN(CC)C(=O)C1=O)c1ccccc1.[Na+]
InChIInChI=1S/C23H27N5O7S.Na/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28;/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34);/q;+1/p-1/t13-,14-,15+,20-;/m1./s1
InChIKeyWCMIIGXFCMNQDS-IDYPWDAWSA-M
ChEBI Ontology
Outgoing Relation(s)
piperacillin sodium (CHEBI:8233) has part piperacillin(1−) (CHEBI:52433)
piperacillin sodium (CHEBI:8233) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium 6β-{(2R)-2-[(4-ethyl-2,3-dioxopiperazin-1-yl)carboxamido]-2-phenylacetamido}-2,2-dimethylpenam-3α-carboxylate
Synonyms  Source
Piperacillin sodiumKEGG COMPOUND
PipracilKEGG COMPOUND
Sodium piperacillinChemIDplus
Manual XrefsDatabases
C07361KEGG COMPOUND
D00466KEGG DRUG
DB00319DrugBank
Registry NumbersSources
Beilstein:5373920Beilstein
CAS:59703-84-3KEGG COMPOUND
CAS:59703-84-3ChemIDplus