{
  "route": {
    "id": "cmisbzzw700w419ddi2mznv2v",
    "signature": "49be0a7be04d934eaa5c44b14ffbcc0e689ec8c78391830194097b2c91d8cd63",
    "length": 3,
    "isConvergent": false
  },
  "target": {
    "id": "cmisbzzw700w319ddilun2ru5",
    "benchmarkSetId": "cmisbzzmb000019dd3k8yeild",
    "targetId": "n5-09618",
    "moleculeId": "jp5w1kgpkj8z26e0ornueumj",
    "routeLength": 3,
    "isConvergent": false,
    "metadata": "{}",
    "molecule": {
      "id": "jp5w1kgpkj8z26e0ornueumj",
      "inchikey": "ZDYYRNNUNOIBDN-UHFFFAOYSA-N",
      "smiles": "O=S(=O)(NC1CCC(=C2c3ccccc3CCc3ccccc32)CC1)c1ccc(OC(F)(F)F)cc1"
    },
    "hasAcceptableRoutes": true,
    "acceptableRoutesCount": 1
  },
  "rootNode": {
    "id": "cmisbzzw800w519ddvzcqluis",
    "routeId": "cmisbzzw700w419ddi2mznv2v",
    "moleculeId": "jp5w1kgpkj8z26e0ornueumj",
    "parentId": null,
    "reactionStepId": "ojisr3nbv4ppukoco2vove3y",
    "isLeaf": false,
    "molecule": {
      "id": "jp5w1kgpkj8z26e0ornueumj",
      "inchikey": "ZDYYRNNUNOIBDN-UHFFFAOYSA-N",
      "smiles": "O=S(=O)(NC1CCC(=C2c3ccccc3CCc3ccccc32)CC1)c1ccc(OC(F)(F)F)cc1"
    },
    "reactionStep": {
      "id": "ojisr3nbv4ppukoco2vove3y",
      "reactionHash": "42fee2dc0ae351b097ad4e0c83f463481187b8b2538bfbcfeae66ccbc9d15631",
      "template": null,
      "metadata": "{\"ID\":\"US20140213578A1;0322;1556345\",\"rsmi\":\"Cl[S:2](=[O:1])(=[O:3])[c:26]1[cH:27][cH:28][c:29]([O:30][C:31]([F:32])([F:33])[F:34])[cH:35][cH:36]1.[NH2:4][CH:5]1[CH2:6][CH2:7][C:8](=[C:9]2[c:10]3[c:11]([cH:12][cH:13][cH:14][cH:15]3)[CH2:16][CH2:17][c:18]3[c:19]2[cH:20][cH:21][cH:22][cH:23]3)[CH2:24][CH2:25]1>CCN(CC)CC.CN(C)C=O>[O:1]=[S:2](=[O:3])([NH:4][CH:5]1[CH2:6][CH2:7][C:8](=[C:9]2[c:10]3[c:11]([cH:12][cH:13][cH:14][cH:15]3)[CH2:16][CH2:17][c:18]3[c:19]2[cH:20][cH:21][cH:22][cH:23]3)[CH2:24][CH2:25]1)[c:26]1[cH:27][cH:28][c:29]([O:30][C:31]([F:32])([F:33])[F:34])[cH:35][cH:36]1\"}"
    },
    "children": [
      {
        "id": "cmisbzzw800w619ddqnotmolf",
        "routeId": "cmisbzzw700w419ddi2mznv2v",
        "moleculeId": "ml32245nfz64e9gn3gttne4t",
        "parentId": "cmisbzzw800w519ddvzcqluis",
        "reactionStepId": "tx5z3dnrord7uo14dph09hec",
        "isLeaf": false,
        "molecule": {
          "id": "ml32245nfz64e9gn3gttne4t",
          "inchikey": "OJEBBLCMGNQXES-UHFFFAOYSA-N",
          "smiles": "NC1CCC(=C2c3ccccc3CCc3ccccc32)CC1"
        },
        "reactionStep": {
          "id": "tx5z3dnrord7uo14dph09hec",
          "reactionHash": "ddb029c1869e8d77c66c45e069e60fdc75e975b43b2b2bee55b835127a46855c",
          "template": null,
          "metadata": "{\"ID\":\"US20140213578A1;0320;1556344\",\"rsmi\":\"O=C(OCc1ccccc1)[NH:1][CH:2]1[CH2:3][CH2:4][C:5](=[C:6]2[c:7]3[c:8]([cH:9][cH:10][cH:11][cH:12]3)[CH2:13][CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[CH2:21][CH2:22]1>CC(=O)O.CCOC(C)=O.CO.[Pd]>[NH2:1][CH:2]1[CH2:3][CH2:4][C:5](=[C:6]2[c:7]3[c:8]([cH:9][cH:10][cH:11][cH:12]3)[CH2:13][CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[CH2:21][CH2:22]1\"}"
        },
        "children": [
          {
            "id": "cmisbzzw900w819ddj894zi3p",
            "routeId": "cmisbzzw700w419ddi2mznv2v",
            "moleculeId": "tdjk71bgctrhaq0eh9kui3oy",
            "parentId": "cmisbzzw800w619ddqnotmolf",
            "reactionStepId": "kdtkr8g7q4dzen9ck63i03ow",
            "isLeaf": false,
            "molecule": {
              "id": "tdjk71bgctrhaq0eh9kui3oy",
              "inchikey": "FEHGZFPCGZAYOH-UHFFFAOYSA-N",
              "smiles": "O=C(NC1CCC(=C2c3ccccc3CCc3ccccc32)CC1)OCc1ccccc1"
            },
            "reactionStep": {
              "id": "kdtkr8g7q4dzen9ck63i03ow",
              "reactionHash": "982a667cbb973e2a426e286b6db3d5796b614e8734ce274165a88c1536b6406b",
              "template": null,
              "metadata": "{\"ID\":\"US20140213578A1;0319;1556343\",\"rsmi\":\"O=[C:7]1[CH2:6][CH2:5][CH:4]([NH:3][C:2](=[O:1])[O:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:24][CH2:23]1.O=[C:8]1[c:9]2[c:10]([cH:11][cH:12][cH:13][cH:14]2)[CH2:15][CH2:16][c:17]2[c:18]1[cH:19][cH:20][cH:21][cH:22]2>C1CCOC1.Cl.Cl[Ti](Cl)(Cl)Cl.[Zn]>[O:1]=[C:2]([NH:3][CH:4]1[CH2:5][CH2:6][C:7](=[C:8]2[c:9]3[c:10]([cH:11][cH:12][cH:13][cH:14]3)[CH2:15][CH2:16][c:17]3[c:18]2[cH:19][cH:20][cH:21][cH:22]3)[CH2:23][CH2:24]1)[O:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1\"}"
            },
            "children": [
              {
                "id": "cmisbzzw900w919dd0fibtpcb",
                "routeId": "cmisbzzw700w419ddi2mznv2v",
                "moleculeId": "htdxbcnso3ylhmqqn05yi4dk",
                "parentId": "cmisbzzw900w819ddj894zi3p",
                "reactionStepId": null,
                "isLeaf": true,
                "molecule": {
                  "id": "htdxbcnso3ylhmqqn05yi4dk",
                  "inchikey": "VHXBIBFCJISKFA-UHFFFAOYSA-N",
                  "smiles": "O=C1CCC(N=C(O)OCc2ccccc2)CC1"
                },
                "reactionStep": null,
                "children": []
              },
              {
                "id": "cmisbzzw900wa19ddoqccmxg8",
                "routeId": "cmisbzzw700w419ddi2mznv2v",
                "moleculeId": "eo1b7xy1n078199tjy6wme2t",
                "parentId": "cmisbzzw900w819ddj894zi3p",
                "reactionStepId": null,
                "isLeaf": true,
                "molecule": {
                  "id": "eo1b7xy1n078199tjy6wme2t",
                  "inchikey": "BMVWCPGVLSILMU-UHFFFAOYSA-N",
                  "smiles": "O=C1c2ccccc2CCc2ccccc21"
                },
                "reactionStep": null,
                "children": []
              }
            ]
          }
        ]
      },
      {
        "id": "cmisbzzw800w719ddjuyj6vlb",
        "routeId": "cmisbzzw700w419ddi2mznv2v",
        "moleculeId": "g10olordv7oowzw2n26aal4e",
        "parentId": "cmisbzzw800w519ddvzcqluis",
        "reactionStepId": null,
        "isLeaf": true,
        "molecule": {
          "id": "g10olordv7oowzw2n26aal4e",
          "inchikey": "UHCDBMIOLNKDHG-UHFFFAOYSA-N",
          "smiles": "O=S(=O)(Cl)c1ccc(OC(F)(F)F)cc1"
        },
        "reactionStep": null,
        "children": []
      }
    ]
  }
}