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  "description" : [ "A guanosine bisphosphate having a diphosphate at the 3'-position and a triphosphate at the 5'-position." ],
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    "charge" : [ "0" ],
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    "inchi" : [ "InChI=1S/C10H18N5O20P5/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-5(16)6(32-39(26,27)33-36(18,19)20)3(31-9)1-30-38(24,25)35-40(28,29)34-37(21,22)23/h2-3,5-6,9,16H,1H2,(H,24,25)(H,26,27)(H,28,29)(H2,18,19,20)(H2,21,22,23)(H3,11,13,14,17)/t3-,5-,6-,9-/m1/s1" ],
    "inchikey" : [ "KCPMACXZAITQAX-UUOKFMHZSA-N" ],
    "mass" : [ "683.14020" ],
    "monoisotopicmass" : [ "682.92332" ],
    "smiles" : [ "Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](OP(O)(=O)OP(O)(O)=O)[C@H]1O" ]
  },
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