{
  "route": {
    "id": "cmisbzzx900zq19ddzs0zytwv",
    "signature": "dc8ab59f074aaf95e272dff13338120985c30e3a8b30dfcef37b07c12afae100",
    "contentHash": "68a4e6305d6b769549243fe2d65596dbff80ef65da13e1f45a9a51160dafa4d6",
    "length": 3,
    "isConvergent": false
  },
  "target": {
    "id": "cmisbzzx900zp19ddc01e6lw5",
    "benchmarkSetId": "cmisbzzmb000019dd3k8yeild",
    "targetId": "n5-08989",
    "moleculeId": "hia84t8v9d608rj8ct6z62ul",
    "routeLength": 3,
    "isConvergent": false,
    "metadata": "{}",
    "molecule": {
      "id": "hia84t8v9d608rj8ct6z62ul",
      "inchikey": "NDIYNXWRBHAEPS-UHFFFAOYSA-N",
      "smiles": "O=c1c(O)cccn1Cc1ccc(-c2ccncc2)cc1"
    },
    "hasAcceptableRoutes": true,
    "acceptableRoutesCount": 1
  },
  "rootNode": {
    "id": "cmisbzzxa00zr19ddmfu0f97g",
    "routeId": "cmisbzzx900zq19ddzs0zytwv",
    "moleculeId": "hia84t8v9d608rj8ct6z62ul",
    "parentId": null,
    "isLeaf": false,
    "reactionHash": null,
    "template": null,
    "metadata": "{\"ID\":\"US20120329741A1;0318;1314356\",\"rsmi\":\"C[O:4][c:3]1[c:2](=[O:1])[n:8]([CH2:9][c:10]2[cH:11][cH:12][c:13](-[c:14]3[cH:15][cH:16][n:17][cH:18][cH:19]3)[cH:20][cH:21]2)[cH:7][cH:6][cH:5]1>BrB(Br)Br.ClCCl>[O:1]=[c:2]1[c:3]([OH:4])[cH:5][cH:6][cH:7][n:8]1[CH2:9][c:10]1[cH:11][cH:12][c:13](-[c:14]2[cH:15][cH:16][n:17][cH:18][cH:19]2)[cH:20][cH:21]1\"}",
    "molecule": {
      "id": "hia84t8v9d608rj8ct6z62ul",
      "inchikey": "NDIYNXWRBHAEPS-UHFFFAOYSA-N",
      "smiles": "O=c1c(O)cccn1Cc1ccc(-c2ccncc2)cc1"
    },
    "children": [
      {
        "id": "cmisbzzxa00zs19dddgkav306",
        "routeId": "cmisbzzx900zq19ddzs0zytwv",
        "moleculeId": "vlyuwu49es047lq478nwdbki",
        "parentId": "cmisbzzxa00zr19ddmfu0f97g",
        "isLeaf": false,
        "reactionHash": null,
        "template": null,
        "metadata": "{\"ID\":\"US20120329741A1;0300;1314354\",\"rsmi\":\"Br[c:12]1[cH:11][cH:10][c:9]([CH2:8][n:7]2[cH:6][cH:5][cH:4][c:3]([O:2][CH3:1])[c:21]2=[O:22])[cH:20][cH:19]1.OB(O)[c:13]1[cH:14][cH:15][n:16][cH:17][cH:18]1>O=C(O)O.[K+].[K+].c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1>[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][n:7]([CH2:8][c:9]2[cH:10][cH:11][c:12](-[c:13]3[cH:14][cH:15][n:16][cH:17][cH:18]3)[cH:19][cH:20]2)[c:21]1=[O:22]\"}",
        "molecule": {
          "id": "vlyuwu49es047lq478nwdbki",
          "inchikey": "ICUMETHWKBNUIC-UHFFFAOYSA-N",
          "smiles": "COc1cccn(Cc2ccc(-c3ccncc3)cc2)c1=O"
        },
        "children": [
          {
            "id": "cmisbzzxa00zt19dd00msrnub",
            "routeId": "cmisbzzx900zq19ddzs0zytwv",
            "moleculeId": "q5dtmczf6z74jiztqv00iw8u",
            "parentId": "cmisbzzxa00zs19dddgkav306",
            "isLeaf": false,
            "reactionHash": null,
            "template": null,
            "metadata": "{\"ID\":\"US20120329741A1;0290;1314353\",\"rsmi\":\"Br[CH2:8][c:9]1[cH:10][cH:11][c:12]([Br:13])[cH:14][cH:15]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][nH:7][c:16]1=[O:17]>C1CCOC1.O=C(O)O.[K+].[K+]>[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][n:7]([CH2:8][c:9]2[cH:10][cH:11][c:12]([Br:13])[cH:14][cH:15]2)[c:16]1=[O:17]\"}",
            "molecule": {
              "id": "q5dtmczf6z74jiztqv00iw8u",
              "inchikey": "FPDPDSHNXDRCRG-UHFFFAOYSA-N",
              "smiles": "COc1cccn(Cc2ccc(Br)cc2)c1=O"
            },
            "children": [
              {
                "id": "cmisbzzxa00zv19ddfp9o97ol",
                "routeId": "cmisbzzx900zq19ddzs0zytwv",
                "moleculeId": "m2j9r803uva4avnu06f7bli8",
                "parentId": "cmisbzzxa00zt19dd00msrnub",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "m2j9r803uva4avnu06f7bli8",
                  "inchikey": "YLRBJYMANQKEAW-UHFFFAOYSA-N",
                  "smiles": "BrCc1ccc(Br)cc1"
                },
                "children": []
              },
              {
                "id": "cmisbzzxa00zw19dd7gjbcto4",
                "routeId": "cmisbzzx900zq19ddzs0zytwv",
                "moleculeId": "ab5m7hldqam69z3go4t3wdeo",
                "parentId": "cmisbzzxa00zt19dd00msrnub",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "ab5m7hldqam69z3go4t3wdeo",
                  "inchikey": "LKIMDXQLHFCXQF-UHFFFAOYSA-N",
                  "smiles": "COc1cccnc1O"
                },
                "children": []
              }
            ]
          },
          {
            "id": "cmisbzzxa00zu19ddtt022lj1",
            "routeId": "cmisbzzx900zq19ddzs0zytwv",
            "moleculeId": "yzqcwacz4oadyowszm49aipc",
            "parentId": "cmisbzzxa00zs19dddgkav306",
            "isLeaf": true,
            "reactionHash": null,
            "template": null,
            "metadata": null,
            "molecule": {
              "id": "yzqcwacz4oadyowszm49aipc",
              "inchikey": "QLULGIRFKAWHOJ-UHFFFAOYSA-N",
              "smiles": "OB(O)c1ccncc1"
            },
            "children": []
          }
        ]
      }
    ]
  }
}