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Substance Name: Rifamycin, 3-(((1-piperidinylmethylene)hydrazono)methyl)-
RN: 86737-06-6
InChIKey: JEGGQYICWGMXOZ-YNTMCLQCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C44-H58-N4-O12

Molecular Weight

  • 834.958
 
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Names and Synonyms

Synonyms

  • 3-(((1-Piperidinylmethylene)hydrazono)methyl)rifamycin
  • 3-(Piperidinomethylazinomethyl)rifamycin SV

Systematic Name

  • Rifamycin, 3-(((1-piperidinylmethylene)hydrazono)methyl)-

Registry Numbers

CAS Registry Number

  • 86737-06-6

System Generated Number

  • 0086737066

Structure Descriptors

InChI

1S/C44H58N4O12/c1-22-14-13-15-23(2)43(56)47-34-29(20-45-46-21-48-17-11-10-12-18-48)38(53)31-32(39(34)54)37(52)27(6)41-33(31)42(55)44(8,60-41)58-19-16-30(57-9)24(3)40(59-28(7)49)26(5)36(51)25(4)35(22)50/h13-16,19-22,24-26,30,35-36,40,50-54H,10-12,17-18H2,1-9H3,(H,47,56)/b14-13+,19-16+,23-15-,45-20+,46-21+/t22-,24+,25+,26+,30-,35-,36+,40+,44-/m0/s1

InChIKey

JEGGQYICWGMXOZ-YNTMCLQCSA-N

Smiles

c12c3O[C@@](C2=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@@H](O)[C@H](C=CC=C(C(Nc2c(c(c1c(c2O)c(O)c3C)O)\C=N\N=C\N1CCCCC1)=O)C)C)C)O)C)OC(=O)C)C)OC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   Journal of Antibiotics. Vol. 37, Pg. 1209, 1984.