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Substance Name: Bulgecin C monosodium salt
RN: 95975-85-2
InChIKey: ATZPBIIZBROOHN-ZSLXANLSSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H23-N2-O12-S.Na

Molecular Weight

  • 466.3937
 
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Names and Synonyms

Results Name

  • Bulgecin C monosodium salt

Synonyms

  • Bulgecin C monosodium salt
  • F3 monosodium salt
  • Substance F3 monosodium salt

Systematic Name

  • L-Proline, 4-((2-(acetylamino)-2-deoxy-4-O-sulfo-beta-D-glucopyranosyl)oxy)-5-(hydroxymethyl)-, monosodium salt, (2-alpha,4-alpha,5-beta)-

Registry Numbers

CAS Registry Number

  • 95975-85-2

System Generated Number

  • 0095975852

Molecular Formulas

Molecular Formula

  • C14-H23-N2-O12-S.Na

Molecular Formula Fragments

  • C14-H23-N2-O12-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H24N2O12S.Na/c1-5(19)15-10-11(20)12(28-29(23,24)25)9(4-18)27-14(10)26-8-2-6(13(21)22)16-7(8)3-17;/h6-12,14,16-18,20H,2-4H2,1H3,(H,15,19)(H,21,22)(H,23,24,25);/q;+1/p-1/t6-,7+,8-,9+,10+,11+,12+,14+;/m0./s1

InChIKey

ATZPBIIZBROOHN-ZSLXANLSSA-M

Smiles

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H]2C[C@H](N[C@@H]2CO)C(=O)[O-])CO)OS(=O)(=O)O)O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #86610,