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Substance Name: 3-((Dimethylhydrazono)methyl)rifamycin SV
RN: 13292-34-7
InChIKey: WAUUAUIPGORSGR-DQBGJZPTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H53-N3-O12

Molecular Weight

  • 767.868
 
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Names and Synonyms

Name of Substance

  • 3-((Dimethylhydrazono)methyl)rifamycin SV

Synonyms

  • BRN 5708769
  • NSC 143445

Systematic Name

  • 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-8-carboxaldehyde, 1,2-dihydro-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-(dimethylhydrazone), 21-acetate

Registry Numbers

CAS Registry Number

  • 13292-34-7

System Generated Number

  • 0013292347

Structure Descriptors

InChI

1S/C40H53N3O12/c1-18-13-12-14-19(2)39(51)42-30-25(17-41-43(9)10)34(48)27-28(35(30)49)33(47)23(6)37-29(27)38(50)40(8,55-37)53-16-15-26(52-11)20(3)36(54-24(7)44)22(5)32(46)21(4)31(18)45/h12-18,20-22,26,31-32,36,45-49H,1-11H3,(H,42,51)/b13-12+,16-15+,19-14-,41-17+/t18-,20+,21+,22+,26-,31-,32+,36+,40-/m0/s1

InChIKey

WAUUAUIPGORSGR-DQBGJZPTSA-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\N(C)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 395mg/kg (395mg/kg)   Chemotherapia. Vol. 12, Pg. 155, 1967.
mouse LD50 oral 2320mg/kg (2320mg/kg)   "Structure-Activity Relationship among the Semisynthetic Antibiotics," Perlman, D., ed., New York, Academic Press, 1977Vol. -, Pg. 531, 1977.