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CHEBI:169605 - Epoxy-hexobarbital

ChEBI IDCHEBI:169605
ChEBI NameEpoxy-hexobarbital
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16N2O4
Net Charge0
Average Mass252.270
Monoisotopic Mass252.11101
SMILESCN1C(=O)NC(=O)C(C)(C23CCCCC2O3)C1=O
InChIInChI=1S/C12H16N2O4/c1-11(12-6-4-3-5-7(12)18-12)8(15)13-10(17)14(2)9(11)16/h7H,3-6H2,1-2H3,(H,13,15,17)
InChIKeyWOWLNDOPAUTOTH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
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)
Epoxy-hexobarbital (CHEBI:169605) is a barbiturates (CHEBI:22693)
IUPAC Name 
1,5-dimethyl-5-(7-oxabicyclo[4.1.0]heptan-1-yl)-1,3-diazinane-2,4,6-trione
Manual XrefsDatabases
150172ChemSpider
HMDB0013941HMDB
Registry NumbersSources
CAS:66403-25-6ChemIDplus