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CHEBI:229539 - durlobactam

ChEBI IDCHEBI:229539
ChEBI Namedurlobactam
Stars
DefinitionA member of the class of azabicycloalkanes that is (1R,2S,5R)-3-methyl-7-oxo-1,6-diazabicyclo[3.2.1]oct-3-ene-2-carboxamide in which the amino hydrogen at position 6 is replaced by a sulfooxy group.
Last Modified6 February 2024
SubmitterAdnan
DownloadsMolfile
FormulaC8H11N3O6S
Net Charge0
Average Mass277.258
Monoisotopic Mass277.03686
SMILESCC1=C[C@@H]2CN(C(=O)N2OS(=O)(=O)O)[C@@H]1C(N)=O
InChIInChI=1S/C8H11N3O6S/c1-4-2-5-3-10(6(4)7(9)12)8(13)11(5)17-18(14,15)16/h2,5-6H,3H2,1H3,(H2,9,12)(H,14,15,16)/t5-,6+/m1/s1
InChIKeyBISPBXFUKNXOQY-RITPCOANSA-N
Wikipedia
Roles Classification
Biological Roles:
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 β-lactamase (EC 3.5.2.6).
antibacterial drug  A drug used to treat or prevent bacterial infections.
Application:
antibacterial drug  A drug used to treat or prevent bacterial infections.
ChEBI Ontology
Outgoing Relation(s)
durlobactam (CHEBI:229539) has role antibacterial drug (CHEBI:36047)
durlobactam (CHEBI:229539) has role EC 3.5.2.6 (β-lactamase) inhibitor (CHEBI:35625)
durlobactam (CHEBI:229539) is a azabicycloalkane (CHEBI:38295)
durlobactam (CHEBI:229539) is a hydroxylamine O-sulfonic acid (CHEBI:38025)
durlobactam (CHEBI:229539) is a monocarboxylic acid amide (CHEBI:29347)
durlobactam (CHEBI:229539) is a primary carboxamide (CHEBI:140324)
durlobactam (CHEBI:229539) is conjugate acid of durlobactam(1−) (CHEBI:229545)
Incoming Relation(s)
durlobactam(1−) (CHEBI:229545) is conjugate base of durlobactam (CHEBI:229539)
IUPAC Name 
(1R,2S,5R)-3-methyl-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]oct-3-ene-2-carboxamide
INNs  Source
durlobactamumWHO MedNet
durlobactamWHO MedNet
durlobactamWHO MedNet
durlobactamWHO MedNet
Synonyms  Source
ETX2514DrugBank
ETX 2514DrugBank
ETX-2514DrugBank
Manual XrefsDatabases
DB16704DrugBank
D11591KEGG DRUG
DurlobactamWikipedia
Registry NumbersSources
CAS:1467829-71-5KEGG DRUG
Citations