CHEBI:219592 - Kleboxymycin

ChEBI IDCHEBI:219592
ChEBI NameKleboxymycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14N2O3
Net Charge0
Average Mass234.255
Monoisotopic Mass234.10044
SMILESO=C1c2cccc(O)c2N[C@@H](O)[C@@H]2CCCN12
InChIInChI=1S/C12H14N2O3/c15-9-5-1-3-7-10(9)13-11(16)8-4-2-6-14(8)12(7)17/h1,3,5,8,11,13,15-16H,2,4,6H2/t8-,11-/m0/s1
InChIKeyQEILHZZUMSPTRX-KWQFWETISA-N
Species of MetaboliteComponentSourceComments
Klebsiella oxytoca (ncbitaxon:571) - PubMed (28972161)
Roles Classification
Biological Role:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
Application:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
ChEBI Ontology
Outgoing Relation(s)
Kleboxymycin (CHEBI:219592) is a benzodiazepine (CHEBI:22720)
IUPAC Name 
(6S,6aS)-4,6-dihydroxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one