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Substance Name: Rifamycin, 1,4-dideoxy-1,4,16,17,18,19-hexahydro-1,4-dioxo-
RN: 13929-42-5
InChIKey: XFVYSNJVWMMLIE-LONSXKSTSA-N

Molecular Formula

  • C37-H49-N-O12

Molecular Weight

  • 699.7891
 
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Names and Synonyms

Synonym

  • Tetrahydrorifamycin S

Systematic Name

  • Rifamycin, 1,4-dideoxy-1,4,16,17,18,19-hexahydro-1,4-dioxo-

Registry Numbers

CAS Registry Number

  • 13929-42-5

System Generated Number

  • 0013929425

Structure Descriptors

InChI

1S/C37H49NO12/c1-16-11-10-12-17(2)36(46)38-23-15-24(40)26-27(32(23)44)31(43)21(6)34-28(26)35(45)37(8,50-34)48-14-13-25(47-9)18(3)33(49-22(7)39)20(5)30(42)19(4)29(16)41/h13-20,25,29-30,33,41-43H,10-12H2,1-9H3,(H,38,46)/b14-13+/t16-,17?,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1

InChIKey

XFVYSNJVWMMLIE-LONSXKSTSA-N

Smiles

Cc1c(c2c3c4c1O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](CCCC(C(=O)NC(=CC3=O)C2=O)C)C)O)C)O)C)OC(=O)C)C)OC)C)O