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Substance Name: Adenosine 5'-(hexahydrogen pentaphosphate), 5'.5'-ester with adenosine, pentalithium salt
RN: 94108-02-8
InChIKey: UCSIUKZZDLEYFE-CSMIRWGRSA-I

Molecular Formula

  • C20-H29-N10-O22-P5.5Li

Molecular Weight

  • 946.0326
 
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Names and Synonyms

Synonym

  • EINECS 302-339-2

Systematic Name

  • Adenosine 5'-(hexahydrogen pentaphosphate), 5'.5'-ester with adenosine, pentalithium salt

Registry Numbers

CAS Registry Number

  • 94108-02-8

System Generated Number

  • 0094108028

Molecular Formulas

Molecular Formula

  • C20-H29-N10-O22-P5.5Li

Molecular Formula Fragments

  • C20-H29-N10-O22-P5
  • COMPONENT
  • Li

Structure Descriptors

InChI

1S/C20H29N10O22P5.5Li/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(47-19)1-45-53(35,36)49-55(39,40)51-57(43,44)52-56(41,42)50-54(37,38)46-2-8-12(32)14(34)20(48-8)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)(H,43,44)(H2,21,23,25)(H2,22,24,26);;;;;/q;5*+1/p-5/t7-,8-,11-,12-,13-,14-,19-,20-;;;;;/m1...../s1

InChIKey

UCSIUKZZDLEYFE-CSMIRWGRSA-I

Smiles

[Li+].[Li+].[Li+].[Li+].[Li+].c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OC[C@@H]4[C@H]([C@H]([C@@H](O4)n5cnc6c5ncnc6N)O)O)O)O)N