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Substance Name: Polyoxin F
RN: 23116-76-9
InChIKey: YOTRXRRLNVGLSU-KXFIGUGUSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C23-H30-N6-O15

Molecular Weight

  • 630.517
 
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Names and Synonyms

Results Name

  • Polyoxin F

Synonym

  • Polyoxin F

Systematic Names

  • 5-Pyrimidinecarboxylic acid, 1-(5-((2-amino-5-O-(aminocarbonyl)-2-deoxy-L-xylonoyl)amino)-6-C-(2-carboxy-3-ethylidene-1-azetidinyl)-5-deoxy-beta-D-allo-hexodialdo-1,4-furanosyl)-1,2,3,4-tetrahydro-2,4-dioxo-, (S-(E))-
  • 5-Pyrimidinecarboxylic acid, 1-(5-(2-amino-2-deoxy-L-xylonamido)-5-((2-carboxy-3-ethylidene-1-azetidinyl)carbonyl)-5-deoxy-beta-D-ribofuranosyl)-1,2,3,4-tetrahydro-2,4-dioxo-, monocarbamate (ester)

Registry Numbers

CAS Registry Number

  • 23116-76-9

Other Registry Number

  • 11043-77-9

System Generated Number

  • 0023116769

Structure Descriptors

InChI

1S/C23H30N6O15/c1-2-6-3-28(11(6)21(39)40)18(36)10(26-17(35)9(24)12(31)8(30)5-43-22(25)41)15-13(32)14(33)19(44-15)29-4-7(20(37)38)16(34)27-23(29)42/h2,4,8-15,19,30-33H,3,5,24H2,1H3,(H2,25,41)(H,26,35)(H,37,38)(H,39,40)(H,27,34,42)/b6-2-

InChIKey

YOTRXRRLNVGLSU-KXFIGUGUSA-N

Smiles

N1(C(=O)[C@@H]([C@@H]2[C@@H](O)[C@@H](O)[C@@H](O2)n2cc(C(=O)O)c([nH]c2=O)=O)NC(=O)[C@@H](N)[C@@H]([C@@H](O)COC(N)=O)O)[C@@H](C(O)=O)C(\C1)=C\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 5, Pg. 248, 1981.