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Substance Name: Rifamycin, 3-((methoxyimino)methyl)-
RN: 13292-54-1
InChIKey: GESKBSXUIDEVON-QODMXWQXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C39-H50-N2-O13

Molecular Weight

  • 754.825
 
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Names and Synonyms

Results Name

  • Rifamycin, 3-((methoxyimino)methyl)-

Synonyms

  • 3-Formylrifamycin SV O-methyloxime
  • AF/MO
  • NSC 143453
  • Rifamycin AF/MO

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-methyloxime
  • 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-8-carboxaldehyde, 1,2-dihydro-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-(O-methyloxime), 21-acetate (8CI)
  • Rifamycin, 3-((methoxyimino)methyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 13292-54-1

System Generated Number

  • 0013292541

Structure Descriptors

InChI

1S/C39H50N2O13/c1-17-12-11-13-18(2)38(49)41-29-24(16-40-51-10)33(46)26-27(34(29)47)32(45)22(6)36-28(26)37(48)39(8,54-36)52-15-14-25(50-9)19(3)35(53-23(7)42)21(5)31(44)20(4)30(17)43/h11-17,19-21,25,30-31,35,43-47H,1-10H3,(H,41,49)/b12-11+,15-14+,18-13-,40-16+/t17-,19+,20+,21+,25-,30-,31+,35+,39-/m0/s1

InChIKey

GESKBSXUIDEVON-QODMXWQXSA-N

Smiles

O(C)\N=C\c1c2NC(=O)C(=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@@H]([C@H](C)[C@@H](OC)C=CO[C@@]3(C)Oc4c(c(c1O)c(c2O)c(O)c4C)C3=O)OC(=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 152mg/kg (152mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 396, 1974.