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Substance Name: 2''-N-Formimidoylistamycin B disulfate tetrahydrate
RN: 77312-56-2
InChIKey: MBVIHFAPAWIFRU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H36-N6-O5.2H2-O4-S.4H2-O

Molecular Weight

  • 612.675
 
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Names and Synonyms

Results Name

  • 2''-N-Formimidoylistamycin B disulfate tetrahydrate

Synonym

  • 2''-N-Formimidoylistamycin B disulfate tetrahydrate

Systematic Name

  • D-allo-Inositol, 2-amino-1-O-(2-amino-2,3,4,6-tetradeoxy-6-(methylamino)-alpha-D-erythro-hexopyranosyl)-2,3,5-trideoxy-5-((((iminomethyl)amino)acetyl)methylamino)-4-O-methyl-, sulfate, hydrate (1:2:4)

Registry Numbers

CAS Registry Number

  • 77312-56-2

System Generated Number

  • 0077312562

Molecular Formulas

Molecular Formula

  • C18-H36-N6-O5.2H2-O4-S.4H2-O

Molecular Formula Fragments

  • C18-H36-N6-O5
  • COMPONENT
  • H2-O
  • H2-O4-S

Structure Descriptors

InChI

1S/C18H36N6O5.2H2O4S/c1-22-7-10-4-5-11(20)18(28-10)29-17-12(21)6-13(27-3)15(16(17)26)24(2)14(25)8-23-9-19;2*1-5(2,3)4/h9-13,15-18,22,26H,4-8,20-21H2,1-3H3,(H2,19,23);2*(H2,1,2,3,4)

InChIKey

MBVIHFAPAWIFRU-UHFFFAOYSA-N

Smiles

CNCC1CCC(C(O1)OC2C(CC(C(C2O)N(C)C(=O)CNC=N)OC)N)N.OS(=O)(=O)O.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 329mg/kg (329mg/kg)   Journal of Antibiotics. Vol. 35, Pg. 1104, 1982.