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Substance Name: FR-295389
RN: 1019207-72-7
UNII: 101N81BBI2
InChIKey: SRULPQKDNUEKQM-ZMNNRNPHSA-N

Molecular Formula

  • C25-H33-N13-O7-S2.H2-O4-S

Molecular Weight

  • 789.8295
 
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Names and Synonyms

Name of Substance

  • FR-295389

Synonyms

  • FR-295389
  • UNII-101N81BBI2

Registry Numbers

CAS Registry Number

  • 1019207-72-7

FDA UNII

  • 101N81BBI2

System Generated Number

  • 1019207727

Structure Descriptors

InChI

1S/C25H33N13O7S2.H2O4S/c1-25(2,22(43)44)45-33-13(16-32-24(29)47-34-16)18(39)31-14-19(40)38-15(21(41)42)11(10-46-20(14)38)8-35-9-12(17-30-5-7-37(17)35)36(23(27)28)6-3-4-26;1-5(2,3)4/h9,14,20H,3-8,10,26H2,1-2H3,(H3,27,28)(H,31,39)(H,41,42)(H,43,44)(H2,29,32,34);(H2,1,2,3,4)/b33-13-;/t14-,20-;/m1./s1

InChIKey

SRULPQKDNUEKQM-ZMNNRNPHSA-N

Smiles

CC(C)(O\N=C(/C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)CN3C=C(N(CCCN)C(=N)N)C4=NCCN34)\c5nsc(N)n5)C(=O)O.OS(=O)(=O)O