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Substance Name: beta-D-ribo-Pentodialdo-1,4-furanose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-(1-piperidinyl)-
RN: 35788-34-2
InChIKey: PJUPECUYTWAJGH-BQVMBELUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-N6-O4

Molecular Weight

  • 348.361
 
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Names and Synonyms

Synonyms

  • 1-(6-Amino-9H-purin-9-yl)-1-deoxy-5-(1-piperidinyl)-beta-D-ribo-pentodialdo-1,4-furanose
  • BRN 0587968

Systematic Name

  • beta-D-ribo-Pentodialdo-1,4-furanose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-(1-piperidinyl)-

Registry Numbers

CAS Registry Number

  • 35788-34-2

System Generated Number

  • 0035788342

Structure Descriptors

InChI

1S/C15H20N6O4/c16-12-8-13(18-6-17-12)21(7-19-8)15-10(23)9(22)11(25-15)14(24)20-4-2-1-3-5-20/h6-7,9-11,15,22-23H,1-5H2,(H2,16,17,18)/t9-,10+,11-,15+/m0/s1

InChIKey

PJUPECUYTWAJGH-BQVMBELUSA-N

Smiles

O=C([C@H]1O[C@@H](n2c3c(nc2)c(ncn3)N)[C@@H](O)[C@@H]1O)N1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 313, 1980.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 313, 1980.