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Substance Name: Rifamycin SV, 8-(4-methylpiperidinomethyl)-
RN: 4075-47-2
InChIKey: KJJDTEBVOWHVKP-PEGQXNTDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C44-H60-N2-O12

Molecular Weight

  • 808.96
 
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Names and Synonyms

Results Name

  • Rifamycin SV, 8-(4-methylpiperidinomethyl)-

Synonyms

  • NCI 144-148
  • Rifamycin SV, 8-(4-methylpiperidinomethyl)-

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 4075-47-2

System Generated Number

  • 0004075472

Structure Descriptors

InChI

1S/C44H60N2O12/c1-21-14-17-46(18-15-21)20-29-34-39(52)32-31(38(29)51)33-41(27(7)37(32)50)58-44(9,42(33)53)56-19-16-30(55-10)24(4)40(57-28(8)47)26(6)36(49)25(5)35(48)22(2)12-11-13-23(3)43(54)45-34/h11-13,16,19,21-22,24-26,30,35-36,40,48-52H,14-15,17-18,20H2,1-10H3,(H,45,54)/b12-11+,19-16+,23-13-

InChIKey

KJJDTEBVOWHVKP-PEGQXNTDSA-N

Smiles

CC1CCN(Cc2c3NC(C(C)=CC=C[C@@H](C)[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@@H]([C@@H](C)[C@@H](OC)C=CO[C@@]4(Oc5c(c(c2O)c(c3O)c(O)c5C)C4=O)C)OC(C)=O)=O)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 680mg/kg (680mg/kg)   Chemotherapia. Vol. 12, Pg. 155, 1967.
mouse LD50 intravenous 188mg/kg (188mg/kg)   Chemotherapia. Vol. 12, Pg. 155, 1967.