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CHEBI:229545 - durlobactam(1−)

ChEBI IDCHEBI:229545
ChEBI Namedurlobactam(1−)
Stars
ASCII Namedurlobactam(1-)
DefinitionAn organosulfate oxoanion that is the conjugate base of durlobactam, obtained by deprotonation of the sulfo group; Major species at pH 7.3.
Last Modified6 February 2024
SubmitterAdnan
DownloadsMolfile
FormulaC8H10N3O6S
Net Charge-1
Average Mass276.250
Monoisotopic Mass276.02958
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)/p-1/t5-,6+/m1/s1
InChIKeyBISPBXFUKNXOQY-RITPCOANSA-M
ChEBI Ontology
Outgoing Relation(s)
durlobactam(1−) (CHEBI:229545) is a organosulfate oxoanion (CHEBI:58958)
durlobactam(1−) (CHEBI:229545) is conjugate base of durlobactam (CHEBI:229539)
Incoming Relation(s)
durlobactam sodium (CHEBI:229544) has part durlobactam(1−) (CHEBI:229545)
durlobactam (CHEBI:229539) is conjugate acid of durlobactam(1−) (CHEBI:229545)
IUPAC Name 
({[(1R,2S,5R)-2-carbamoyl-3-methyl-7-oxo-1,6-diazabicyclo[3.2.1]oct-3-en-6-yl]oxy}sulfonyl)oxidanide
Synonym  Source
durlobactam anionChEBI