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Substance Name: P(1)-Adenylyl-5'-2'-adenylyl-5'-2'-adenosyl-P(3)-n-decylaminotriphosphate
RN: 96902-45-3
InChIKey: DUHGULOUBZGUTH-HFSNTALBSA-N

Note

  • Phosphate-resistant, active pppA2'p5'A2'p5'A analog.

Molecular Weight

  • 1304.88
 
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Names and Synonyms

Name of Substance

  • P(1)-Adenylyl-5'-2'-adenylyl-5'-2'-adenosyl-P(3)-n-decylaminotriphosphate

Synonyms

  • Dnpppapapa
  • n-Decyl-nhpppa2'p5'A2'p5'A

Registry Numbers

CAS Registry Number

  • 96902-45-3

System Generated Number

  • 0096902453

Structure Descriptors

InChI

1S/C40H61N16O24P5/c1-2-3-4-5-6-7-8-9-10-53-81(61,62)79-85(69,70)80-84(67,68)73-13-22-28(59)31(40(76-22)56-19-52-25-34(43)46-16-49-37(25)56)78-83(65,66)72-12-21-27(58)30(39(75-21)55-18-51-24-33(42)45-15-48-36(24)55)77-82(63,64)71-11-20-26(57)29(60)38(74-20)54-17-50-23-32(41)44-14-47-35(23)54/h14-22,26-31,38-40,57-60H,2-13H2,1H3,(H,63,64)(H,65,66)(H,67,68)(H,69,70)(H2,41,44,47)(H2,42,45,48)(H2,43,46,49)(H2,53,61,62)/t20-,21-,22-,26-,27-,28-,29-,30-,31?,38-,39-,40-/m1/s1

InChIKey

DUHGULOUBZGUTH-HFSNTALBSA-N

Smiles

N([P@@](=O)(O)O[P@@](=O)(O)O[P@@](=O)(OC[C@H]1O[C@H]([C@@H](O[P@@](=O)(OC[C@@H]2[C@H]([C@@H](O[P@@](=O)(OC[C@@H]3[C@@H](O)[C@@H](O)[C@@H](O3)n3cnc4c(ncnc34)N)O)[C@@H](O2)n2c3c(nc2)c(ncn3)N)O)O)[C@@H]1O)n1cnc2c1ncnc2N)O)CCCCCCCCCC