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Substance Name: 44-Homooligomycin A
RN: 132707-68-7
InChIKey: APJPYXAUMOLFTM-YLWQDIMZSA-N

Note

  • Isolated from Streptomyces bottropensis.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C46-H76-O11

Molecular Weight

  • 805.095
 
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Names and Synonyms

Name of Substance

  • 44-Homooligomycin A

Synonyms

  • 26-Demethyl-26-ethyloligomycin
  • 44-Homooligomycin A
  • NK86-0279II

Systematic Name

  • Oligomycin, 26-demethyl-26-ethyl-

Registry Numbers

CAS Registry Number

  • 132707-68-7

System Generated Number

  • 0132707687

Structure Descriptors

InChI

1S/C46H76O11/c1-12-34-18-16-14-15-17-28(5)43(52)45(11,54)44(53)33(10)41(51)32(9)40(50)31(8)39(49)27(4)19-22-38(48)55-42-30(7)36(21-20-34)56-46(35(42)13-2)24-23-26(3)37(57-46)25-29(6)47/h14-16,18-19,22,26-37,39,41-43,47,49,51-52,54H,12-13,17,20-21,23-25H2,1-11H3/b15-14-,18-16-,22-19+

InChIKey

APJPYXAUMOLFTM-YLWQDIMZSA-N

Smiles

O1[C@@]2(CC[C@@H](C)[C@@H]1C[C@@H](C)O)O[C@@H]1[C@@H]([C@@H]([C@@H]2CC)OC(C=C[C@@H]([C@@H]([C@@H](C)C([C@@H]([C@@H]([C@@H](C([C@@]([C@@H]([C@@H](C)CC=CC=C[C@@H](CC)CC1)O)(C)O)=O)C)O)C)=O)O)C)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1050ug/kg (1.05mg/kg)   Journal of Antibiotics. Vol. 45, Pg. 171, 1992.