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Substance Name: Tallysomycin fragment WA
RN: 70518-45-5
InChIKey: ZFRQNKRBJQEKSA-UHFFFAOYSA-N

Molecular Formula

  • C37-H65-N11-O11-S2

Molecular Weight

  • 904.119
 
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Names and Synonyms

Results Name

  • Tallysomycin fragment WA

Synonyms

  • N-(4-Amino-6-((3-((4-aminobutyl)amino)propyl)amino)-6-oxohexyl)-2'-(2-((4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy)-2-((2-((4-amino-2,4,5-trideoxy-erythro-pentonoyl)amino)-3-hydroxy-1-oxobutyl)amino)-1-hydroxyethyl)-(2,4'-bithiazole)-4-carboxamide
  • Tallysomycin fragment WA

Systematic Name

  • (2,4'-Bithiazole)-4-carboxamide, N-(4-amino-6-((3-((4-aminobutyl)amino)propyl)amino)-6-oxohexyl)-2'-(2-((4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy)-2-((2-((4-amino-2,4,5-trideoxy-erythro-pentonoyl)amino)-3-hydroxy-1-oxobutyl)amino)-1-hydroxyethyl)-

Registry Numbers

CAS Registry Number

  • 70518-45-5

System Generated Number

  • 0070518455

Structure Descriptors

InChI

1S/C37H65N11O11S2/c1-18(39)24(50)15-26(52)47-28(19(2)49)33(57)48-34(59-37-30(54)29(53)27(41)20(3)58-37)31(55)36-46-23(17-61-36)35-45-22(16-60-35)32(56)44-12-6-8-21(40)14-25(51)43-13-7-11-42-10-5-4-9-38/h16-21,24,27-31,34,37,42,49-50,53-55H,4-15,38-41H2,1-3H3,(H,43,51)(H,44,56)(H,47,52)(H,48,57)

InChIKey

ZFRQNKRBJQEKSA-UHFFFAOYSA-N

Smiles

c1(nc(cs1)C(=O)NCCC[C@@H](CC(NCCCNCCCCN)=O)N)c1csc(n1)[C@@H]([C@@H](O[C@@H]1O[C@@H](C)[C@@H](N)[C@@H](O)[C@@H]1O)NC([C@@H]([C@@H](C)O)NC(C[C@@H]([C@@H](C)N)O)=O)=O)O