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Substance Name: Rifamycin p-iodophenylamide
RN: 13232-69-4
InChIKey: BHDJFLBHWKKNQU-FMAVLDMNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C45-H53-I-N2-O13

Molecular Weight

  • 956.815
 
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Names and Synonyms

Results Name

  • Rifamycin p-iodophenylamide

Synonym

  • Rifamycin p-iodophenylamide

Systematic Name

  • Acetanilide, 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)-4'-iodo-, 21-acetate

Registry Numbers

CAS Registry Number

  • 13232-69-4

System Generated Number

  • 0013232694

Structure Descriptors

InChI

1S/C45H53IN2O13/c1-21-11-10-12-22(2)44(56)48-30-19-32(58-20-33(50)47-29-15-13-28(46)14-16-29)34-35(40(30)54)39(53)26(6)42-36(34)43(55)45(8,61-42)59-18-17-31(57-9)23(3)41(60-27(7)49)25(5)38(52)24(4)37(21)51/h10-19,21,23-25,31,37-38,41,51-54H,20H2,1-9H3,(H,47,50)(H,48,56)/b11-10+,18-17+,22-12-

InChIKey

BHDJFLBHWKKNQU-FMAVLDMNSA-N

Smiles

c12cc(c3c4c(c(c(c3c2O)O)C)O[C@@](C)(C4=O)OC=C[C@@H](OC)[C@@H](C)[C@@H]([C@@H](C)[C@@H]([C@@H](C)[C@@H]([C@@H](C)C=CC=C(C)C(N1)=O)O)O)OC(C)=O)OCC(=O)Nc1ccc(cc1)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 98mg/kg (98mg/kg) LIVER: CHANGE IN GALL BLADDER STRUCTURE OR FUNCTION Chemotherapia. Vol. 12, Pg. 155, 1967.