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Substance Name: Barbituric acid, 1-(4-hydroxycyclohexyl)-5-octyl-
RN: 4101-98-8
InChIKey: VJWDELPKRRZFTM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H30-N2-O4

Molecular Weight

  • 338.445
 
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Names and Synonyms

Synonyms

  • 1-(4-Hydroxycyclohexyl)-5-octylbarbituric acid
  • 5-24-09-00178 (Beilstein Handbook Reference)
  • BRN 0762238

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 4101-98-8

System Generated Number

  • 0004101988

Structure Descriptors

InChI

1S/C18H30N2O4/c1-2-3-4-5-6-7-8-15-16(22)19-18(24)20(17(15)23)13-9-11-14(21)12-10-13/h13-15,21H,2-12H2,1H3,(H,19,22,24)

InChIKey

VJWDELPKRRZFTM-UHFFFAOYSA-N

Smiles

N1(C2CCC(O)CC2)C([C@@H](C(=O)NC1=O)CCCCCCCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 6200mg/kg (6200mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 89, Pg. 254, 1969.