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Substance Name: Isoalloxazine, 7-chloro-10-(4-(diethylamino)-1-methylbutyl)-, sulfate
RN: 101651-92-7
InChIKey: AQQZAHFUJIPVSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-Cl-N5-O2.H2-O4-S

Molecular Weight

  • 487.962
 
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Names and Synonyms

Synonym

  • 7-Chloro-10-(4-(diethylamino)-1-methylbutyl)isoalloxazine sulfate

Systematic Name

  • Isoalloxazine, 7-chloro-10-(4-(diethylamino)-1-methylbutyl)-, sulfate

Registry Numbers

CAS Registry Number

  • 101651-92-7

System Generated Number

  • 0101651927

Molecular Formulas

Molecular Formula

  • C19-H23-Cl-N5-O2.H2-O4-S

Molecular Formula Fragments

  • C19-H23-Cl-N5-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C19H24ClN5O2.H2O4S/c1-4-24(5-2)10-6-7-12(3)25-15-9-8-13(20)11-14(15)21-16-17(25)22-19(27)23-18(16)26;1-5(2,3)4/h8-9,11-12H,4-7,10H2,1-3H3,(H,23,26,27);(H2,1,2,3,4)

InChIKey

AQQZAHFUJIPVSM-UHFFFAOYSA-N

Smiles

c12n(c3c(cc(Cl)cc3)nc1c([nH]c(n2)=O)=O)[C@@H](CCC[NH+](CC)CC)C.S(O)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 60mg/kg (60mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.
mouse LD50 subcutaneous 45mg/kg (45mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.