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Substance Name: L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(4-(3-pyridinylcarbonyl)-1-piperazinyl)-, 5-nitrate
RN: 134186-21-3
InChIKey: IPCFJCRANDEEFR-BYNSBNAKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-N4-O6

Molecular Weight

  • 364.356
 
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Names and Synonyms

Synonyms

  • 1,4:3,6-Dianhydro-2-deoxy-2-(4-(3-pyridinylcarbonyl)-1-piperazinyl)-L-iditol 5-nitrate
  • 5-Deoxy-5-(4-(pyridin-3-yl)carbonylpiperazin-1-yl)-1,4:3,6-dianhydro-L-iditol 2-nitrate

Systematic Name

  • L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(4-(3-pyridinylcarbonyl)-1-piperazinyl)-, 5-nitrate

Registry Numbers

CAS Registry Number

  • 134186-21-3

System Generated Number

  • 0134186213

Structure Descriptors

InChI

1S/C16H20N4O6/c21-16(11-2-1-3-17-8-11)19-6-4-18(5-7-19)12-9-24-15-13(26-20(22)23)10-25-14(12)15/h1-3,8,12-15H,4-7,9-10H2/t12-,13-,14+,15+/m0/s1

InChIKey

IPCFJCRANDEEFR-BYNSBNAKSA-N

Smiles

c1cc(cnc1)C(=O)N2CCN(CC2)[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 LD intraperitoneal > 100mg/kg (100mg/kg)   United States Patent Document. Vol. #5053408,
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #5053408,