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CHEBI:190538 - Flunitrazepam-d3

ChEBI IDCHEBI:190538
ChEBI NameFlunitrazepam-d3
Stars
Last Modified17 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H9D3FN3O3
Net Charge0
Average Mass316.306
Monoisotopic Mass316.10510
SMILES[2H]C([2H])([2H])N1C(=O)CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21
InChIInChI=1S/C16H12FN3O3/c1-19-14-7-6-10(20(22)23)8-12(14)16(18-9-15(19)21)11-4-2-3-5-13(11)17/h2-8H,9H2,1H3/i1D3
InChIKeyPPTYJKAXVCCBDU-FIBGUPNXSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) liver (BTO:0000759) MetaboLights (MTBLS4163)
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)
Flunitrazepam-d3 (CHEBI:190538) is a benzodiazepine (CHEBI:22720)
IUPAC Name 
5-(2-fluorophenyl)-7-nitro-1-(trideuteriomethyl)-3H-1,4-benzodiazepin-2-one
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