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CHEBI:51811 - ticarcillin(2−)

Default Structure
ChEBI IDCHEBI:51811
ChEBI Nameticarcillin(2−)
Stars
ASCII Nameticarcillin(2-)
Last Modified2 December 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC15H14N2O6S2
Net Charge-2
Average Mass382.419
Monoisotopic Mass382.03043
SMILES[H][C@](C(=O)[O-])(C(=O)N[C@@H]1C(=O)N2[C@@H](C(=O)[O-])C(C)(C)S[C@]12[H])c1ccsc1
InChIInChI=1S/C15H16N2O6S2/c1-15(2)9(14(22)23)17-11(19)8(12(17)25-15)16-10(18)7(13(20)21)6-3-4-24-5-6/h3-5,7-9,12H,1-2H3,(H,16,18)(H,20,21)(H,22,23)/p-2/t7-,8-,9+,12-/m1/s1
InChIKeyOHKOGUYZJXTSFX-KZFFXBSXSA-L
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
ticarcillin(2−) (CHEBI:51811) is a penicillinate anion (CHEBI:51356)
ticarcillin(2−) (CHEBI:51811) is conjugate base of ticarcillin (CHEBI:9587)
Incoming Relation(s)
ticarcillin disodium (CHEBI:35017) has part ticarcillin(2−) (CHEBI:51811)
ticarcillin (CHEBI:9587) is conjugate acid of ticarcillin(2−) (CHEBI:51811)
IUPAC Name 
6β-{[(2R)-2-carboxylato-2-thiophen-3-ylacetyl]amino}-2,2-dimethylpenam-3α-carboxylate
Synonym  Source
(2S,5R,6R)-6-{[(2R)-2-carboxylato-2-thiophen-3-ylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylateIUPAC
Registry NumbersSources
Beilstein:5780670Beilstein