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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-7-(2,3-dihydroxypropyl)-1-methyl-3-(2-methylpropyl)-
RN: 132560-20-4
InChIKey: DTZZLOACXJNFIL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N4-O4

Molecular Weight

  • 296.325
 
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Names and Synonyms

Synonyms

  • BRN 4203006
  • Xanthine, 7-(2,3-dihydroxypropyl)-3-isobutyl-1-methyl-

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(2,3-dihydroxypropyl)-1-methyl-3-(2-methylpropyl)-

Registry Numbers

CAS Registry Number

  • 132560-20-4

System Generated Number

  • 0132560204

Structure Descriptors

InChI

1S/C13H20N4O4/c1-8(2)4-17-11-10(12(20)15(3)13(17)21)16(7-14-11)5-9(19)6-18/h7-9,18-19H,4-6H2,1-3H3

InChIKey

DTZZLOACXJNFIL-UHFFFAOYSA-N

Smiles

CC(C)CN1C(=O)N(C)C(=O)c2c1ncn2CC(O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 784mg/kg (784mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 25, Pg. 653, 1990.