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CHEBI:190563 - Phenobarbital-d5

ChEBI IDCHEBI:190563
ChEBI NamePhenobarbital-d5
Stars
Last Modified23 January 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H7D5N2O3
Net Charge0
Average Mass237.270
Monoisotopic Mass237.11618
SMILES[2H]C([2H])([2H])C([2H])([2H])C1(c2ccccc2)C(=O)NC(=O)NC1=O
InChIInChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17)/i1D3,2D2
InChIKeyDDBREPKUVSBGFI-ZBJDZAJPSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) liver (BTO:0000759) MetaboLights (MTBLS4163)
ChEBI Ontology
Outgoing Relation(s)
Phenobarbital-d5 (CHEBI:190563) is a deuterated compound (CHEBI:76107)
Phenobarbital-d5 (CHEBI:190563) is a pyrimidone (CHEBI:38337)
IUPAC Name 
5-(1,1,2,2,2-pentadeuterioethyl)-5-phenyl-1,3-diazinane-2,4,6-trione
Manual XrefsDatabases
23936996ChemSpider
Registry NumbersSources
CAS:73738-05-3ChemIDplus