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aprobarbital

Properties

Image

Occurences in reactions

MNX_ID

MNXM42448

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₀H₁₄N₂O₃

charge

mass

210.10044

reference

InChIKey

UORJNBVJVRLXMQ-UHFFFAOYSA-N

InChI

InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15)

SMILES

C=CCC1(C(C)C)C(=O)NC(=O)NC1=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:2791 chebi:2791	aprobarbital 5-(1-methylethyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 5-(propan-2-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione 5-allyl-5-isopropylbarbituric acid 5-allyl-5-isopropylpyrimidine-2,4,6(1H,3H,5H)-trione 5-isopropyl-5-allylbarbituric acid Allypropymal Alurate Aprobarbital
seed.compound:cpd04912 seedM:cpd04912 kegg.compound:C07826 keggC:C07826	Aprobarbital
kegg.drug:D00698 keggD:D00698	Aprobarbital (INN) Alurate (TN)
hmdb:HMDB0015441	Aprobarbital 5-(1-Methylethyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 5-(prop-2-en-1-yl)-5-(propan-2-yl)-1,3-diazinane-2,4,6-trione 5-Allyl-5-isopropylbarbitate 5-Allyl-5-isopropylbarbitic acid 5-Allyl-5-isopropylbarbituric acid 5-Allyl-5-isopropylpyrimidine-2,4,6(1H,3H,5H)-trione 5-Isopropyl-5-allylbarbitate 5-Isopropyl-5-allylbarbitic acid 5-Isopropyl-5-allylbarbituric acid Alate Alic acid Allylpropymal Allylpropymal, monosodium salt Allypropymal Alurate Aluric acid Aprobarbitone aprobarbital
hmdb:HMDB15441 keggC:M_C07826 keggD:M_D00698 seedM:M_cpd04912	secondary/obsolete/fantasy identifier