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Substance Name: Phosphorothioic acid, S-(3-(3-aminopropylamino)-2-hydroxy)propyl ester
RN: 56643-49-3
InChIKey: NMTZXNJYQSPJGV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H17-N2-O4-P-S

Molecular Weight

  • 244.25
 
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Names and Synonyms

Synonyms

  • BRN 2448395
  • S-3-(omega-Aminopropylamino)-2-hydroxypropyl dihydrogen phosphorothioate

Systematic Name

  • Phosphorothioic acid, S-(3-(3-aminopropylamino)-2-hydroxy)propyl ester

Registry Numbers

CAS Registry Number

  • 56643-49-3

System Generated Number

  • 0056643493

Structure Descriptors

InChI

1S/C6H17N2O4PS/c7-2-1-3-8-4-6(9)5-14-13(10,11)12/h6,8-9H,1-5,7H2,(H2,10,11,12)

InChIKey

NMTZXNJYQSPJGV-UHFFFAOYSA-N

Smiles

S(P(O)(=O)O)C[C@@H](O)CNCCCN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 875mg/kg (875mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 803, 1975.
mouse LD50 oral 1200mg/kg (1200mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 803, 1975.