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Substance Name: 9H-Purin-6-amine, 9-beta-D-arabinofuranosyl-N-((dimethylamino)methylene)-
RN: 25816-87-9
InChIKey: ALIMWRMSWXTSDB-SHILPKQESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-N6-O4

Molecular Weight

  • 322.323
 
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Names and Synonyms

Synonyms

  • 9-beta-D-Arabinofuranosyl-N-((dimethylamino)methylene)-9H-purin-6-amine
  • N(sup 6)-(Dimethylamino)methylene(9-beta-D-arabinofuranosyl)adenine

Systematic Name

  • 9H-Purin-6-amine, 9-beta-D-arabinofuranosyl-N-((dimethylamino)methylene)-

Registry Numbers

CAS Registry Number

  • 25816-87-9

System Generated Number

  • 0025816879

Structure Descriptors

InChI

1S/C13H18N6O4/c1-18(2)5-17-11-8-12(15-4-14-11)19(6-16-8)13-10(22)9(21)7(3-20)23-13/h4-7,9-10,13,20-22H,3H2,1-2H3/b17-5+/t7-,9-,10+,13-/m1/s1

InChIKey

ALIMWRMSWXTSDB-SHILPKQESA-N

Smiles

O1[C@H]([C@H]([C@@H](O)[C@H]1CO)O)n1c2c(c(\N=C\N(C)C)ncn2)nc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 3200mg/kg (3200mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 290, 1973.