Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetic acid, ((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)-, 21-acetate, 2,2-dibutyl-1-methylhydrazide
RN: 38123-27-2
InChIKey: JWNNXONLLXGFSQ-GGVGXGRWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C48-H69-N3-O13

Molecular Weight

  • 896.0811
 
* 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

  • BRN 5418833
  • NSC 144141
  • Rifamycin B dibutylmethylhydrazide

Systematic Names

  • Acetic acid, ((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)-, 21-acetate, 2,2-dibutyl-1-methylhydrazide
  • Rifamycin, 4-O-(2-(2,2-dibutyl-1-methylhydrazino)-2-oxoethyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 38123-27-2

System Generated Number

  • 0038123272

Structure Descriptors

InChI

1S/C48H69N3O13/c1-13-15-21-51(22-16-14-2)50(11)36(53)25-61-35-24-33-43(57)38-37(35)39-45(31(8)42(38)56)64-48(10,46(39)58)62-23-20-34(60-12)28(5)44(63-32(9)52)30(7)41(55)29(6)40(54)26(3)18-17-19-27(4)47(59)49-33/h17-20,23-24,26,28-30,34,40-41,44,54-57H,13-16,21-22,25H2,1-12H3,(H,49,59)/b18-17+,23-20+,27-19-

InChIKey

JWNNXONLLXGFSQ-GGVGXGRWSA-N

Smiles

CCCCN(CCCC)N(C)C(=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 198mg/kg (198mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 596, 1964.