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Substance Name: P(1),P(2)-Bis(6-mercaptopurine-9 beta-ribofuranoside)-5'-pyrophosphate
RN: 83385-99-3
InChIKey: LPIKNCIDBJMEJO-XPWFQUROSA-N

Note

  • Partially circumvents resistance to 6-mercaptopurine.

Molecular Weight

  • 710.533
 
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Names and Synonyms

Name of Substance

  • P(1),P(2)-Bis(6-mercaptopurine-9 beta-ribofuranoside)-5'-pyrophosphate

Synonym

  • Bis(mprp)

Systematic Name

  • Inosine 5'-(trihydrogen diphosphate), 6-thio-, 5'-5'-ester with 6-thioinosine

Registry Numbers

CAS Registry Number

  • 83385-99-3

System Generated Number

  • 0083385993

Structure Descriptors

InChI

1S/C20H24N8O13P2S2/c29-11-7(39-19(13(11)31)27-5-25-9-15(27)21-3-23-17(9)44)1-37-14-12(30)8(2-38-43(35,36)41-42(32,33)34)40-20(14)28-6-26-10-16(28)22-4-24-18(10)45/h3-8,11-14,19-20,29-31H,1-2H2,(H,35,36)(H,21,23,44)(H,22,24,45)(H2,32,33,34)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1

InChIKey

LPIKNCIDBJMEJO-XPWFQUROSA-N

Smiles

O(C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c(S)ncnc12)[C@@H]1[C@@H]([C@@H](CO[P@@](OP(=O)(O)O)(=O)O)O[C@H]1n1cnc2c(S)ncnc12)O