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Substance Name: Barbituric acid, 1-(4-hydroxycyclohexyl)-5-isopentyl-
RN: 4400-66-2
InChIKey: LXYKCFFPTGIOJS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-N2-O4

Molecular Weight

  • 296.365
 
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Names and Synonyms

Synonyms

  • 1-(4-Hydroxycyclohexyl)-5-isopentylbarbituric acid
  • 5-24-09-00157 (Beilstein Handbook Reference)
  • BRN 0759250

Systematic Name

  • Barbituric acid, 1-(4-hydroxycyclohexyl)-5-isopentyl-

Registry Numbers

CAS Registry Number

  • 4400-66-2

System Generated Number

  • 0004400662

Structure Descriptors

InChI

1S/C15H24N2O4/c1-9(2)3-8-12-13(19)16-15(21)17(14(12)20)10-4-6-11(18)7-5-10/h9-12,18H,3-8H2,1-2H3,(H,16,19,21)

InChIKey

LXYKCFFPTGIOJS-UHFFFAOYSA-N

Smiles

C1(NC([C@@H](C(N1C1CCC(CC1)O)=O)CCC(C)C)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1800mg/kg (1800mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 89, Pg. 254, 1969.