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Substance Name: Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-N-benzyl-1-deoxy-
RN: 57872-79-4
InChIKey: VDAITUUOENAMKK-PFHKOEEOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N6-O4

Molecular Weight

  • 370.3672
 
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Names and Synonyms

Synonyms

  • 1-(6-Amino-9H-purin-9-yl)-N-benzyl-1-deoxyribofuranuronamide
  • Adenosine-5'-(N-benzyl)carboxamide
  • BRN 0591237

Systematic Name

  • Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-N-benzyl-1-deoxy-

Registry Numbers

CAS Registry Number

  • 57872-79-4

System Generated Number

  • 0057872794

Structure Descriptors

InChI

1S/C17H18N6O4/c18-14-10-15(21-7-20-14)23(8-22-10)17-12(25)11(24)13(27-17)16(26)19-6-9-4-2-1-3-5-9/h1-5,7-8,11-13,17,24-25H,6H2,(H,19,26)(H2,18,20,21)/t11-,12+,13-,17+/m0/s1

InChIKey

VDAITUUOENAMKK-PFHKOEEOSA-N

Smiles

c1ccc(cc1)CNC(=O)[C@@H]2[C@H]([C@H]([C@@H](O2)n3cnc4c3ncnc4N)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/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.