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Substance Name: L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(6-(dimethylamino)-9H-purin-9-yl)-, 5-nitrate
RN: 81621-16-1
InChIKey: YVHLUOATXVIKBV-OINDSLJFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-N6-O5

Molecular Weight

  • 336.3064
 
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Names and Synonyms

Synonyms

  • 1,4:3,6-Dianhydro-2-deoxy-2-(6-(dimethylamino)-9H-purin-9-yl)-L-iditol 5-nitrate
  • 5-(6-Dimethylaminopurin-9-yl)-5-desoxy-1.4;3.6-dianhydro-L-iditol 2-nitrate

Systematic Name

  • L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(6-(dimethylamino)-9H-purin-9-yl)-, 5-nitrate

Registry Numbers

CAS Registry Number

  • 81621-16-1

System Generated Number

  • 0081621161

Structure Descriptors

InChI

1S/C13H16N6O5/c1-17(2)12-9-13(15-5-14-12)18(6-16-9)7-3-22-11-8(24-19(20)21)4-23-10(7)11/h5-8,10-11H,3-4H2,1-2H3/t7-,8-,10+,11+/m0/s1

InChIKey

YVHLUOATXVIKBV-OINDSLJFSA-N

Smiles

CN(C)c1c2c(ncn1)n(cn2)[C@H]3CO[C@H]4[C@@H]3OC[C@@H]4O[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4622324,