Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Rifamycin, 3-(((4-(2-propenyl)-1-piperazinyl)imino)methyl)-
RN: 56964-36-4
InChIKey: KXDRIGPABJFGKX-MMPCIYJBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C45-H60-N4-O12

Molecular Weight

  • 848.985
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 3-(((4-(2-Propenyl)-1-piperazinyl)imino)methyl)rifamycin
  • 3-(4-(2-Propenyl)-1-piperazinyl)iminomethylrifamycin SV

Systematic Name

  • Rifamycin, 3-(((4-(2-propenyl)-1-piperazinyl)imino)methyl)-

Registry Numbers

CAS Registry Number

  • 56964-36-4

System Generated Number

  • 0056964364

Structure Descriptors

InChI

1S/C45H60N4O12/c1-11-16-48-17-19-49(20-18-48)46-22-30-35-40(55)33-32(39(30)54)34-42(28(7)38(33)53)61-45(9,43(34)56)59-21-15-31(58-10)25(4)41(60-29(8)50)27(6)37(52)26(5)36(51)23(2)13-12-14-24(3)44(57)47-35/h11-15,21-23,25-27,31,36-37,41,51-55H,1,16-20H2,2-10H3,(H,47,57)/b13-12+,21-15+,24-14-,46-22+/t23-,25+,26+,27+,31-,36-,37+,41+,45-/m0/s1

InChIKey

KXDRIGPABJFGKX-MMPCIYJBSA-N

Smiles

c12c3O[C@@](C2=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@H](C)[C@H]([C@H](C=CC=C(C(Nc2c(c(c1c(c2\C=N\N1CCN(CC1)CC=C)O)c(c3C)O)O)=O)C)C)O)O)C)OC(=O)C)C)OC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700mg/kg (700mg/kg)   United States Patent Document. Vol. #4002754,
mouse LD50 oral 1500mg/kg (1500mg/kg)   United States Patent Document. Vol. #4002754,