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Substance Name: Isoalloxazine, 7,8-dichloro-10-(2-(dimethylamino)ethyl)-, sulfate
RN: 101652-02-2
InChIKey: ILWSCPUNIIYEBG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H13-Cl2-N5-O2.H2-O4-S

Molecular Weight

  • 452.273
 
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Names and Synonyms

Synonym

  • 7,8-Dichloro-10-(2-(dimethylamino)ethyl)isoalloxazine sulfate

Systematic Name

  • Isoalloxazine, 7,8-dichloro-10-(2-(dimethylamino)ethyl)-, sulfate

Registry Numbers

CAS Registry Number

  • 101652-02-2

System Generated Number

  • 0101652022

Molecular Formulas

Molecular Formula

  • C14-H13-Cl2-N5-O2.H2-O4-S

Molecular Formula Fragments

  • C14-H13-Cl2-N5-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C14H13Cl2N5O2.H2O4S/c1-20(2)3-4-21-10-6-8(16)7(15)5-9(10)17-11-12(21)18-14(23)19-13(11)22;1-5(2,3)4/h5-6H,3-4H2,1-2H3,(H,19,22,23);(H2,1,2,3,4)

InChIKey

ILWSCPUNIIYEBG-UHFFFAOYSA-N

Smiles

n1(c2c(nc3c([nH]c(nc13)=O)=O)cc(Cl)c(c2)Cl)CC[NH+](C)C.S(O)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.
mouse LD50 subcutaneous 30mg/kg (30mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.