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Substance Name: Racemomycinic A acid, tetrahydrochloride
RN: 102489-97-4
InChIKey: TVKAUJAJKXQQLT-CLRCCKQUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H36-N8-O9.4Cl-H

Molecular Weight

  • 666.384
 
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Names and Synonyms

  • 1H-Imidazole-4-carboxylic acid, 2-((4-O-(aminocarbonyl)-2-deoxy-2-((3,6-diamino-1-oxohexyl)amino)-beta-D-glucopyranosyl)amino)-5-(2-amino-1-hydroxyethyl)-4,5-dihydro-, tetrahydrochloride, (4S-(2(R*),4alpha,5beta(S*)))-
  • Racemomycinic A acid, tetrahydrochloride

Registry Numbers

CAS Registry Number

  • 102489-97-4

System Generated Number

  • 0102489974

Molecular Formulas

Molecular Formula

  • C19-H36-N8-O9.4Cl-H

Molecular Formula Fragments

  • C19-H36-N8-O9
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H36N8O9.4ClH/c20-3-1-2-7(22)4-10(30)24-13-14(31)15(36-18(23)34)9(6-28)35-16(13)27-19-25-11(8(29)5-21)12(26-19)17(32)33;;;;/h7-9,11-16,28-29,31H,1-6,20-22H2,(H2,23,34)(H,24,30)(H,32,33)(H2,25,26,27);4*1H/t7?,8?,9-,11?,12+,13-,14-,15-,16-;;;;/m1..../s1

InChIKey

TVKAUJAJKXQQLT-CLRCCKQUSA-N

Smiles

C(CC(CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1NC2=N[C@@H](C(N2)C(CN)O)C(=O)O)CO)OC(=O)N)O)N)CN.Cl.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg)   Journal of Antibiotics. Vol. 24, Pg. 662, 1971.