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Substance Name: Rifamycin B ethylamide
RN: 38327-40-1
InChIKey: UDCVVHBNXAUZCQ-WVTVNRGESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H54-N2-O13

Molecular Weight

  • 782.8786
 
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Names and Synonyms

Results Name

  • Rifamycin B ethylamide

Synonyms

  • BRN 5418205
  • NCI 143-422
  • Rifamycin B ethylamide

Systematic Name

  • Acetamide, 2-((1,2-dihydro-5,6,17,19,21-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-2,7-(epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-9-yl)oxy)-N-ethyl-, 21-acetate

Registry Numbers

CAS Registry Number

  • 38327-40-1

System Generated Number

  • 0038327401

Structure Descriptors

InChI

1S/C41H54N2O13/c1-11-42-29(45)18-53-28-17-26-36(49)31-30(28)32-38(24(7)35(31)48)56-41(9,39(32)50)54-16-15-27(52-10)21(4)37(55-25(8)44)23(6)34(47)22(5)33(46)19(2)13-12-14-20(3)40(51)43-26/h12-17,19,21-23,27,33-34,37,46-49H,11,18H2,1-10H3,(H,42,45)(H,43,51)/b13-12+,16-15+,20-14-

InChIKey

UDCVVHBNXAUZCQ-WVTVNRGESA-N

Smiles

CCNC(=O)COc1cc2c(c3c1c4c(c(c3O)C)OC(C4=O)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(\C(=O)N2)/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 719mg/kg (719mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 596, 1964.