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Substance Name: 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-1,11(2H)-dione, 3-formyl-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-, 21-acetate, O-isopropyloxime
RN: 38128-92-6
InChIKey: ZAKLXRDOCZXZJI-RYIGVIQESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H54-N2-O13

Molecular Weight

  • 782.8786
 
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Names and Synonyms

Synonyms

  • 3-Formylrifamycin SV O-isopropyloxime
  • BRN 5418210
  • NSC 143473
  • Rifamycin AF/O9

Systematic Names

  • 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-1,11(2H)-dione, 3-formyl-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-, 21-acetate, O-isopropyloxime
  • Rifamycin, 3-(((1-methylethoxy)imino)methyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 38128-92-6

System Generated Number

  • 0038128926

Structure Descriptors

InChI

1S/C41H54N2O13/c1-18(2)56-42-17-26-31-36(49)29-28(35(26)48)30-38(24(8)34(29)47)55-41(10,39(30)50)53-16-15-27(52-11)21(5)37(54-25(9)44)23(7)33(46)22(6)32(45)19(3)13-12-14-20(4)40(51)43-31/h12-19,21-23,27,32-33,37,45-49H,1-11H3,(H,43,51)/b13-12+,16-15+,20-14-,42-17+

InChIKey

ZAKLXRDOCZXZJI-RYIGVIQESA-N

Smiles

Cc1c(c2c3c4c1OC(C4=O)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(\C(=O)Nc(c2O)c(c3O)/C=N/OC(C)C)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 94mg/kg (94mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 396, 1974.