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Substance Name: Antibiotic G-418, sulfate (salt)
RN: 49662-05-7
InChIKey: UHEPSJJJMTWUCP-DHDYTCSHSA-N

Molecular Formula

  • C20-H40-N4-O10.x-H2-O4-S

Molecular Weight

  • 692.71
 
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Names and Synonyms

Synonym

  • G-418 sulfate

Systematic Name

  • Antibiotic G-418, sulfate (salt)

Registry Numbers

CAS Registry Number

  • 49662-05-7

System Generated Number

  • 0049662057

Molecular Formulas

Molecular Formula

  • C20-H40-N4-O10.x-H2-O4-S

Molecular Formula Fragments

  • C20-H40-N4-O10
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C20H40N4O10.2H2O4S/c1-6(25)14-11(27)10(26)9(23)18(32-14)33-15-7(21)4-8(22)16(12(15)28)34-19-13(29)17(24-3)20(2,30)5-31-19;2*1-5(2,3)4/h6-19,24-30H,4-5,21-23H2,1-3H3;2*(H2,1,2,3,4)/t6-,7+,8-,9-,10-,11+,12+,13-,14-,15-,16+,17-,18-,19-,20+;;/m1../s1

InChIKey

UHEPSJJJMTWUCP-DHDYTCSHSA-N

Smiles

O([C@@H]1[C@@H](O)[C@H](O[C@H]2O[C@@H]([C@H]([C@@H](O)[C@H]2N)O)[C@H](O)C)[C@@H](N)C[C@H]1N)[C@@H]1[C@H](O)[C@H]([C@](C)(CO1)O)NC.S(O)(O)(=O)=O.S(O)(O)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 144mg/kg (144mg/kg)   Antimicrobial Agents and Chemotherapy. Vol. 6, Pg. 579, 1974.
mouse LD50 subcutaneous 1257mg/kg (1257mg/kg)   Antimicrobial Agents and Chemotherapy. Vol. 6, Pg. 579, 1974.