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Substance Name: Guanidine, 1-(3,4-dimethoxyphenethyl)-, sulfate (2:1)
RN: 13333-60-3
InChIKey: PAEWKHRTFKKYAP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H17-N3-O2.1/2H2-O4-S

Molecular Weight

  • 321.352
 
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Names and Synonyms

Synonyms

  • 1-(3,4-Dimethoxyphenethyl)guanidine sulfate (2:1)
  • NSC 61123

Systematic Name

  • Guanidine, 1-(3,4-dimethoxyphenethyl)-, sulfate (2:1)

Registry Numbers

CAS Registry Number

  • 13333-60-3

System Generated Number

  • 0013333603

Molecular Formulas

Molecular Formula

  • C11-H17-N3-O2.1/2H2-O4-S

Molecular Formula Fragments

  • C11-H17-N3-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C11H17N3O2.H2O4S/c1-15-9-4-3-8(7-10(9)16-2)5-6-14-11(12)13;1-5(2,3)4/h3-4,7H,5-6H2,1-2H3,(H4,12,13,14);(H2,1,2,3,4)

InChIKey

PAEWKHRTFKKYAP-UHFFFAOYSA-N

Smiles

c1(c(cc(CC[NH+]C(=N)[NH2+])cc1)OC)OC.S(=O)(=O)([O-])[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 13mg/kg (13mg/kg)   Therapie. Vol. 23, Pg. 1221, 1968.