CHEBI:201445 - Ampicillin Sodium Mixture With Sulbactam Sodium

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Ampicillin Sodium Mixture With Sulbactam Sodium
ChEBI ID CHEBI:201445
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H18N3O4S.C9H11O5S.Na.Na
Net Charge 0
Average Mass 625.620
Monoisotopic Mass 625.11406
InChI InChI=1S/C16H19N3O4S.C9H12O5S.2Na/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;1-9(2)7(8(11)12)6-4(10)3-5(6)15(9,13)14;;/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);5-7H,3H2,1-2H3,(H,11,12);;/q;;2*+1/p-2
InChIKey NWOYIVRVSJDTLK-UHFFFAOYSA-L
SMILES S1(=O)(=O)C(C(C(=O)[O-])C2C1CC2=O)(C)C.S1C(C(C(=O)[O-])N2C1C(NC(=O)C(N)C3=CC=CC=C3)C2=O)(C)C.[Na+].[Na+]
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): allergen
A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
(via penicillin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ampicillin Sodium Mixture With Sulbactam Sodium (CHEBI:201445) is a penicillin (CHEBI:17334)
IUPAC Name
disodium;(2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;(1R,4S)-3,3-dimethyl-2,2,6-trioxo-2lambda6-thiabicyclo[3.2.0]heptane-4-carboxylate
Manual Xref Database
57524670 ChemSpider
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