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Substance Name: Antibiotic X 14667A sodium salt
RN: 75761-63-6
InChIKey: UKOINTXRBRXQEB-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C44-H68-N-O12.Na

Molecular Weight

  • 826.0062
 
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Names and Synonyms

Results Name

  • Antibiotic X 14667A sodium salt

Synonyms

  • 16-Deethyl-16-methylmonensin 26-((2-phenylethyl)carbamate) monosodium salt
  • Antibiotic X 14667A

Systematic Name

  • Monensin, 16-deethyl-16-methyl-, 26-((2-phenylethyl)carbamate), monosodium salt

Registry Numbers

CAS Registry Number

  • 75761-63-6

System Generated Number

  • 0075761636

Molecular Formulas

Molecular Formula

  • C44-H68-N-O12.Na

Molecular Formula Fragments

  • C44-H68-N-O12
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C44H69NO12.Na/c1-25-21-27(3)44(50,24-52-40(49)45-20-16-31-13-11-10-12-14-31)56-35(25)33-22-26(2)38(53-33)42(8)17-15-34(54-42)41(7)18-19-43(57-41)23-32(46)28(4)37(55-43)29(5)36(51-9)30(6)39(47)48;/h10-14,25-30,32-38,46,50H,15-24H2,1-9H3,(H,45,49)(H,47,48);/q;+1/p-1

InChIKey

UKOINTXRBRXQEB-UHFFFAOYSA-M

Smiles

CC1CC(C(OC1C2CC(C(O2)C3(CCC(O3)C4(CCC5(O4)CC(C(C(O5)C(C)C(C(C)C(=O)[O-])OC)C)O)C)C)C)(COC(=O)NCCc6ccccc6)O)C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   Journal of Antibiotics. Vol. 36, Pg. 1195, 1983.
mouse LD50 oral 150mg/kg (150mg/kg)   Journal of Antibiotics. Vol. 36, Pg. 1195, 1983.