{"created":1786321793278,"createdBy":"ADMIN","lastEdited":1786321793278,"lastEditedBy":"ADMIN","deprecated":false,"uuid":"d4a86106-1d34-477b-8ddc-ad2b3a682a95","definitionType":"PRIMARY","definitionLevel":"COMPLETE","substanceClass":"chemical","status":"approved","version":"7","approvedBy":"FDA_SRS","approvalID":"3G64B4AFQN","structure":{"id":"51ba6937-e2da-4a2c-983e-d4ec4148b4e1","created":1786321793279,"lastEdited":1786321793283,"deprecated":false,"digest":"b8debe9c2a54919d342f3b8bdd481d54c93a2451","molfile":"\n  Marvin  01132104152D          \n\n 22 23  0  0  1  0            999 V2000\n   11.9830   -6.0327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.8115   -5.2257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.0268   -4.9707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4245   -4.6736    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   13.2090   -4.9286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7170   -4.2785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.4896   -3.4855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.1736   -3.0243    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   14.8237   -3.5322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.6361   -3.3888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.1663   -4.0209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8841   -4.7960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.0717   -4.9393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5415   -4.2785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.2530   -3.8668    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   11.4408   -3.6587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.0805   -4.2070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.1271   -2.9870    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n   11.6350   -2.3369    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   10.3101   -2.8722    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   10.0011   -2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.7936   -3.5660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  2  3  2  0  0  0  0\n  4  2  1  0  0  0  0\n  4  5  1  1  0  0  0\n  5  6  1  0  0  0  0\n  7  6  2  0  0  0  0\n  8  7  1  0  0  0  0\n  9  8  1  0  0  0  0\n  9 10  1  0  0  0  0\n 10 11  2  0  0  0  0\n 11 12  1  0  0  0  0\n 12 13  2  0  0  0  0\n 13 14  1  0  0  0  0\n 14  9  2  0  0  0  0\n  6 14  1  0  0  0  0\n 15  4  1  0  0  0  0\n 15 16  1  0  0  0  0\n 16 17  2  0  0  0  0\n 18 16  1  0  0  0  0\n 19 18  1  0  0  0  0\n 18 20  1  6  0  0  0\n 20 21  1  0  0  0  0\n 20 22  1  0  0  0  0\nM  END","smiles":"CC(C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)N","formula":"C16H21N3O3","opticalActivity":"UNSPECIFIED","atropisomerism":"No","stereoCenters":2,"definedStereo":2,"ezCenters":0,"charge":0,"mwt":303.3569,"count":1,"createdBy":"ADMIN","lastEditedBy":"ADMIN","stereochemistry":"ABSOLUTE","access":[],"references":["7d96a813-dcc3-46d3-9e32-af56d39dd090","47280fc9-3d0a-435c-9a2f-470c1b584b3d"],"_inchiKey":"LZDNBBYBDGBADK-KBPBESRZSA-N","_inchi":"InChI=1S/C16H21N3O3/c1-9(2)14(17)15(20)19-13(16(21)22)7-10-8-18-12-6-4-3-5-11(10)12/h3-6,8-9,13-14,18H,7,17H2,1-2H3,(H,19,20)(H,21,22)/t13-,14-/m0/s1","hash":"LZDNBBYBDGBADK_KBPBESRZSA_N"},"_name":"VALYLTRYPTOPHAN","_approvalIDDisplay":"3G64B4AFQN","access":[],"_self":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)?view=full","_moieties":{"count":1,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/moieties"},"_names":{"count":7,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/names"},"_codes":{"count":8,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/codes"},"_properties":{"count":0,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/properties"},"_relationships":{"count":0,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/relationships"},"_references":{"count":12,"url":"https://gsrs.ncats.nih.gov/api/v1/substances(d4a86106-1d34-477b-8ddc-ad2b3a682a95)/references"}}