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Substance Name: Decanoic acid, ester with 5-butyl-1-(4-hydroxycyclohexyl)barbituric acid
RN: 21330-97-2
InChIKey: SDMUOFJUIGEWBM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H40-N2-O5

Molecular Weight

  • 436.589
 
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Names and Synonyms

Synonyms

  • 5-24-09-00133 (Beilstein Handbook Reference)
  • 5-Butyl-1-(4-hydroxycyclohexyl)barbituric acid decanoate
  • BRN 0724453

Systematic Name

  • Decanoic acid, ester with 5-butyl-1-(4-hydroxycyclohexyl)barbituric acid

Registry Numbers

CAS Registry Number

  • 21330-97-2

System Generated Number

  • 0021330972

Structure Descriptors

InChI

1S/C24H40N2O5/c1-3-5-7-8-9-10-11-13-21(27)31-19-16-14-18(15-17-19)26-23(29)20(12-6-4-2)22(28)25-24(26)30/h18-20H,3-17H2,1-2H3,(H,25,28,30)

InChIKey

SDMUOFJUIGEWBM-UHFFFAOYSA-N

Smiles

C(CCCCCCCCC)(=O)OC1CCC(CC1)N1C([C@@H](C(NC1=O)=O)CCCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 7gm/kg (7000mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 89, Pg. 254, 1969.