avibactam (CHEBI:85984)

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ChEBI Name	avibactam

ChEBI ID	CHEBI:85984

Definition	A member of the class of azabicycloalkanes that is (2S,5R)-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamide in which the amino hydrogen at position 6 is replaced by a sulfooxy group. Used (in the form of its sodium salt) in combination with ceftazidime pentahydrate for the treatment of complicated urinary tract infections including pyelonephritis.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C7H11N3O6S

Net Charge

Average Mass

265.24400

Monoisotopic Mass

265.03686

InChI

InChI=1S/C7H11N3O6S/c8-6(11)5-2-1-4-3-9(5)7(12)10(4)16-17(13,14)15/h4-5H,1-3H2,(H2,8,11)(H,13,14,15)/t4-,5+/m1/s1

InChIKey

NDCUAPJVLWFHHB-UHNVWZDZSA-N

SMILES

NC(=O)[C@@H]1CC[C@@H]2CN1C(=O)N2OS(O)(=O)=O

Roles Classification
Biological Role(s):	antibacterial drug A drug used to treat or prevent bacterial infections. EC 3.5.2.6 (beta-lactamase) inhibitor An EC 3.5.2.* (non-peptide cyclic amide C-N hydrolase) inhibitor that interferes with the action of beta-lactamase (EC 3.5.2.6). antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.

Application(s):	antibacterial drug A drug used to treat or prevent bacterial infections.

ChEBI Ontology
Outgoing	avibactam (CHEBI:85984) has role antibacterial drug (CHEBI:36047) avibactam (CHEBI:85984) has role antimicrobial agent (CHEBI:33281) avibactam (CHEBI:85984) has role EC 3.5.2.6 (β-lactamase) inhibitor (CHEBI:35625) avibactam (CHEBI:85984) is a azabicycloalkane (CHEBI:38295) avibactam (CHEBI:85984) is a hydroxylamine O-sulfonic acid (CHEBI:38025) avibactam (CHEBI:85984) is a monocarboxylic acid amide (CHEBI:29347) avibactam (CHEBI:85984) is a ureas (CHEBI:47857) avibactam (CHEBI:85984) is conjugate acid of avibactam(1−) (CHEBI:85988)

Incoming	avibactam(1−) (CHEBI:85988) is conjugate base of avibactam (CHEBI:85984)

IUPAC Name

(2S,5R)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide

Last Modified

22 February 2017