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Substance Name: Adenosine, 5'-(pentahydrogen tetraphosphate), 5',5'-ester with adenosine, tetraammonium salt
RN: 102783-36-8
InChIKey: COBCSHRAXKIEQE-LKZCCGPLSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H28-N10-O19-P4.4H3-N

Molecular Weight

  • 904.511
 
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Names and Synonyms

Synonyms

  • 5'-(Pentahydrogen tetraphosphate)adenosine 5'-5'-ester with adenosine tetraammonium salt
  • Diadenosine 5',5'''-P(sup 1),P(sup 4)-tetraphosphate tetraammonium salt

Systematic Name

  • Adenosine, 5'-(pentahydrogen tetraphosphate), 5',5'-ester with adenosine, tetraammonium salt

Registry Numbers

CAS Registry Number

  • 102783-36-8

System Generated Number

  • 0102783368

Molecular Formulas

Molecular Formula

  • C20-H28-N10-O19-P4.4H3-N

Molecular Formula Fragments

  • C20-H28-N10-O19-P4
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

1S/C20H28N10O19P4.4H3N/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(45-19)1-43-50(35,36)47-52(39,40)49-53(41,42)48-51(37,38)44-2-8-12(32)14(34)20(46-8)30-6-28-10-16(22)24-4-26-18(10)30;;;;/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)(H2,21,23,25)(H2,22,24,26);4*1H3/t7-,8-,11-,12-,13-,14-,19-,20-;;;;/m1..../s1

InChIKey

COBCSHRAXKIEQE-LKZCCGPLSA-N

Smiles

n1(c2c(c(ncn2)N)nc1)[C@@H]1O[C@H](CO[P@@](O[P@@](O[P@@](O[P@@](OC[C@H]2O[C@@H](n3c4c(c(ncn4)N)nc3)[C@@H]([C@@H]2O)O)(O)=O)(O)=O)(O)=O)(O)=O)[C@H]([C@H]1O)O.N.N.N.N