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Substance Name: 3-Formylrifamycin SV O-(oct-3-yl)oxime
RN: 41776-71-0
InChIKey: NVLVVILZTJSCTK-DMKCPYNESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C46-H64-N2-O13

Molecular Weight

  • 853.0126
 
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Names and Synonyms

Results Name

  • 3-Formylrifamycin SV O-(oct-3-yl)oxime

Synonyms

  • 3-Formylrifamycin SV O-(oct-3-yl)oxime
  • BRN 5418604

Systematic Name

  • 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-1,11(2H)-dione, 3-formyl-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-, 21-acetate, O-(oct-3-yl)oxime

Registry Numbers

CAS Registry Number

  • 41776-71-0

System Generated Number

  • 0041776710

Structure Descriptors

InChI

1S/C46H64N2O13/c1-12-14-15-19-30(13-2)61-47-22-31-36-41(54)34-33(40(31)53)35-43(28(8)39(34)52)60-46(10,44(35)55)58-21-20-32(57-11)25(5)42(59-29(9)49)27(7)38(51)26(6)37(50)23(3)17-16-18-24(4)45(56)48-36/h16-18,20-23,25-27,30,32,37-38,42,50-54H,12-15,19H2,1-11H3,(H,48,56)/b17-16+,21-20+,24-18-,47-22+

InChIKey

NVLVVILZTJSCTK-DMKCPYNESA-N

Smiles

CCCCCC(CC)O/N=C/c1c2c(c3c(c1O)c4c(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 89mg/kg (89mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 396, 1974.