SMILES for Ryanodine receptor 1

44 SMILES Strings for Ryanodine receptor 1

Compound Name

SMILES String

CC(C)C1(O)C(OC(=O)c2ccc[nH]2)C2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C |TLB:33:31:29:19.21.18,14:31:21:16.29.18,20:19:31.14:29,3:33:21:16.29.18,5:14:29:19.21.18,28:29:31.33:21,28:29:31.14:19.21.18,THB:32:31:21:16.29.18,32:31:29:19.21.18,33:19:31.14:29,15:14:29:19.21.18,14:16:31.33:21,30:29:31.33:21,30:29:31.14:19.21.18,34:33:21:16.29.18|

BDBM50044991

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](O)C(=C)CCC35O)C2(O)C14C |TLB:33:31:29:19.21.18,5:14:29:19.21.18,20:19:31.14:29,28:29:31.14:19.21.18,THB:15:14:29:19.21.18,33:19:31.14:29,32:31:29:19.21.18,30:29:31.14:19.21.18|

BDBM50044985

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCC([O-])=O)C(C)CCC35O)C2(O)C14C |TLB:39:38:3.5:16.19.18,36:16:40:22.21,3:40:22.21:14.16.18,15:14:22.36:40.19.18,15:14:40:22.21,20:19:38:3.5,6:5:38:16.19.18,THB:22:38:3.5:16.19.18,41:40:22.21:14.16.18,36:22:40:14.16.18,36:16:38:3.5,5:14:22.36:40.19.18,5:14:40:22.21,21:19:38:3.5,23:22:40:14.16.18,4:3:38:16.19.18|

BDBM50044995

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCN)C(C)CCC35O)C2(O)C14C |TLB:15:14:22.34:38.19.18,15:14:38:22.21,37:36:3.5:16.19.18,34:16:38:22.21,3:38:22.21:14.16.18,20:19:36:3.5,6:5:36:16.19.18,THB:22:36:3.5:16.19.18,34:22:38:14.16.18,34:16:36:3.5,5:14:22.34:38.19.18,5:14:38:22.21,21:19:36:3.5,23:22:38:14.16.18,4:3:36:16.19.18,39:38:22.21:14.16.18|

BDBM50044990

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C |TLB:47:46:3.5:16.19.18,44:16:48:22.21,3:48:22.21:14.16.18,15:14:22.44:48.19.18,15:14:48:22.21,20:19:46:3.5,6:5:46:16.19.18,THB:22:46:3.5:16.19.18,49:48:22.21:14.16.18,44:22:48:14.16.18,44:16:46:3.5,5:14:22.44:48.19.18,5:14:48:22.21,21:19:46:3.5,23:22:48:14.16.18,4:3:46:16.19.18|

BDBM50044989

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(N)=N)C(C)CCC35O)C2(O)C14C |TLB:37:16:41:22.21,15:14:22.37:41.19.18,15:14:41:22.21,40:39:3.5:16.19.18,3:41:22.21:14.16.18,20:19:39:3.5,6:5:39:16.19.18,THB:22:39:3.5:16.19.18,42:41:22.21:14.16.18,37:22:41:14.16.18,37:16:39:3.5,5:14:22.37:41.19.18,5:14:41:22.21,21:19:39:3.5,23:22:41:14.16.18,4:3:39:16.19.18|

BDBM50044987

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(NC(=O)OCc6ccccc6)=NC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C |w:42.44,TLB:57:16:61:22.21,3:61:22.21:14.16.18,60:59:3.5:16.19.18,15:14:22.57:61.19.18,15:14:61:22.21,6:5:59:16.19.18,20:19:59:3.5,THB:22:59:3.5:16.19.18,57:22:61:14.16.18,57:16:59:3.5,4:3:59:16.19.18,5:14:22.57:61.19.18,5:14:61:22.21,21:19:59:3.5,23:22:61:14.16.18,62:61:22.21:14.16.18|

BDBM50044982

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CN)C(C)CCC35O)C2(O)C14C |TLB:15:14:22.33:37.19.18,15:14:37:22.21,36:35:3.5:16.19.18,33:16:37:22.21,3:37:22.21:14.16.18,20:19:35:3.5,6:5:35:16.19.18,THB:22:35:3.5:16.19.18,33:22:37:14.16.18,33:16:35:3.5,5:14:22.33:37.19.18,5:14:37:22.21,21:19:35:3.5,23:22:37:14.16.18,4:3:35:16.19.18,38:37:22.21:14.16.18|

BDBM50044993

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C |TLB:43:16:47:22.21,15:14:22.43:47.19.18,15:14:47:22.21,46:45:3.5:16.19.18,3:47:22.21:14.16.18,20:19:45:3.5,6:5:45:16.19.18,THB:22:45:3.5:16.19.18,48:47:22.21:14.16.18,43:22:47:14.16.18,43:16:45:3.5,5:14:22.43:47.19.18,5:14:47:22.21,21:19:45:3.5,23:22:47:14.16.18,4:3:45:16.19.18|

BDBM50044986

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(N)=N)C(C)CCC35O)C2(O)C14C |TLB:36:16:40:22.21,39:38:3.5:16.19.18,3:40:22.21:14.16.18,15:14:22.36:40.19.18,15:14:40:22.21,6:5:38:16.19.18,20:19:38:3.5,THB:22:38:3.5:16.19.18,41:40:22.21:14.16.18,36:22:40:14.16.18,36:16:38:3.5,5:14:22.36:40.19.18,5:14:40:22.21,21:19:38:3.5,23:22:40:14.16.18,4:3:38:16.19.18|

BDBM50044984

CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(NC(=O)OCc6ccccc6)=NC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C |w:41.43,TLB:56:16:60:22.21,3:60:22.21:14.16.18,15:14:22.56:60.19.18,15:14:60:22.21,59:58:3.5:16.19.18,6:5:58:16.19.18,20:19:58:3.5,THB:22:58:3.5:16.19.18,56:22:60:14.16.18,56:16:58:3.5,4:3:58:16.19.18,5:14:22.56:60.19.18,5:14:60:22.21,21:19:58:3.5,61:60:22.21:14.16.18,23:22:60:14.16.18|

BDBM50044992

CC(C)C1=C(C)C2(O)C(O)([C@@H]1OC(=O)c1ccc[nH]1)[C@@]1(C)CC(=O)OC22[C@H](OC(=O)CCN)C(C)CCC12O |wU:19.21,wD:10.11,26.29,c:3,TLB:4:6:37:24.22.21,10:8:37:24.22.21,38:37:6.8:24.22.21,THB:9:8:37:24.22.21,7:6:37:24.22.21,36:37:6.8:24.22.21,(4.84,-6.94,;5.24,-5.46,;4.15,-4.37,;6.73,-5.07,;8.7,-5.01,;7.91,-3.67,;9.98,-4.14,;10.15,-2.63,;10.09,-5.53,;9.22,-3.56,;8.23,-6.17,;8.22,-7.7,;7.45,-9.03,;8.21,-10.35,;5.91,-9.01,;5.01,-7.77,;3.54,-8.24,;3.53,-9.77,;4.98,-10.26,;11.98,-6.31,;13.08,-7.39,;12.12,-8.19,;9.93,-8.89,;9.35,-10.29,;10.49,-6.7,;11.52,-4.98,;12.73,-4,;11.4,-3.23,;11.42,-.94,;12.75,-.17,;10.1,-.17,;10.1,1.36,;8.77,2.14,;14,-4.87,;15.08,-3.77,;15.42,-4.74,;14.31,-5.89,;12.77,-4.91,;14.15,-3.33,)|

BDBM50016408

CC(C)C1=C(C)[C@@]2(O)[C@@](O)([C@@H]1OC(=O)c1ccc[nH]1)[C@@]1(C)CC(=O)O[C@@]22[C@H](O)[C@@H](C)CC[C@]12O |c:3,TLB:23:22:6.8:32|

BDBM50016402

CC(C)[C@@]1(O)[C@@H](O)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C(=C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:13:12:22:24.7,26:12:22:24.7|

BDBM50016415

CC(C)[C@@]1(O)[C@@H](O)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:26:12:22:7.24,13:12:22:7.24|

BDBM50016420

CC(C)[C@@]1(O)[C@@H](OC(=O)c2[nH]c(Br)c(Br)c2Br)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:36:22:32:34.17,23:22:32:34.17|

BDBM50044994

CC(C)[C@@]1(O)[C@@H](OC(=O)c2cc[nH]c2)[C@@]2(O)[C@]3(C)C[C@@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,TLB:28:29:31.33:21,34:33:21:29.16.18,THB:14:16:31.33:21,14:31:21:29.16.18,3:33:21:29.16.18,33:19:29:31.14,32:31:21:29.16.18|

BDBM50016414

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5(C(=O)C(C)=CC[C@]35O)[C@@]2(O)[C@]14C |r,c:27,THB:33:19:29:31.14,20:19:29:31.14|

BDBM50016418

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5(C(=O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:33:19:29:31.14,20:19:29:31.14|

BDBM50016403

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C(=C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:33:19:29:31.14,20:19:29:31.14|

BDBM50016411

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C6(CO6)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:34:19:30:32.14,20:19:30:32.14|

BDBM50016410

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:33:19:29:31.14,20:19:29:31.14|

BDBM50016404

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@](O)(CO)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:35:19:31:33.14,20:19:31:33.14|

BDBM50016416

CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](OC(C)=O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:36:19:32:34.14,20:19:32:34.14|

BDBM50016417

CC(C)[C@@]1(O)[C@@H](OC(=O)c2cccn2Cc2ccccc2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:40:26:36:38.21,27:26:36:38.21|

BDBM50016413

CC(CO)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C |r,THB:34:20:30:32.15,21:20:30:32.15|

BDBM50016405

CCCCn1cccc1C(=O)O[C@@H]1[C@](O)(C(C)C)[C@]2(C)[C@]3(O)C[C@@]4(C)[C@@]5(O)CC[C@H](C)[C@@H](O)[C@]5(O3)[C@]2(O)[C@@]14O |r,THB:18:20:25:35.37,21:20:25:35.37|

BDBM50044988

CNC(=O)CCC(=O)O[C@@H]1C(C)CCC2(O)[C@]3(C)CC4(O)OC12C1(O)C3(O)[C@H](OC(=O)c2ccc[nH]2)C(O)(C(C)C)C41C |TLB:22:23:36.27:16.19.18,14:16:41:22.21,14:16:23:36.27,26:25:22.14:41.19.18,26:25:41:22.21,21:19:23:36.27,28:27:23:16.19.18,42:41:22.21:25.16.18,THB:24:23:36.27:16.19.18,14:22:41:25.16.18,36:41:22.21:25.16.18,27:25:22.14:41.19.18,27:25:41:22.21,9:22:41:25.16.18,20:19:23:36.27,37:36:23:16.19.18|

BDBM50222771

CNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl

BDBM50016407

CO[C@@H]1[C@@H](C)CC[C@]2(O)[C@]3(C)C[C@]4(OC)O[C@]12[C@@]1(O)[C@]4(C)[C@@](O)(C(C)C)[C@@H](OC(=O)c2cccn2C)[C@@]31OC |r,THB:19:12:7:17.36,13:12:7:17.36|

BDBM50016409

CO[C@@]12C[C@@]3(C)[C@@]4(O)CC[C@H](C)[C@@H](O)[C@]4(O1)[C@@]1(O)[C@]2(C)[C@@](O)(C(C)C)[C@@H](OC(=O)c2cccn2C)[C@@]31OC |r,THB:18:2:6:16.35,1:2:6:16.35|

BDBM50016406

CO[C@@]12C[C@@]3(C)[C@@]4(O)CC[C@H](C)[C@@H](O)[C@]4(O1)[C@]1(O)[C@@]3(O)[C@H](OC(=O)c3cccn3C)[C@](O)(C(C)C)[C@]21C |r,THB:35:2:6:16.18,1:2:6:16.18|

BDBM50016412

CO[C@@]12C[C@@]3(C)[C@]4(CC[C@H](C)[C@@H](O)[C@]4(O1)[C@]1(O)[C@@]3(O)[C@H](OC(=O)c3cccn3C)[C@](O)(C(C)C)[C@]21C)OC |r,THB:34:2:6:15.17,1:2:6:15.17|

BDBM50241986

O[C@@H]1CNC(=O)C(Cc2cc(Br)c(O)c(Oc3ccc(CC(N=O)C(=O)NCCc4cc(Br)c(O)c(Oc5ccc1cc5Br)c4)cc3Br)c2)N=O |r|

BDBM50241983

O\N=C1/Cc2cc(Br)c(Oc3cc(C\C(=N/O)C(=O)N\C=C\c4ccc(Oc5cc(CCNC1=O)cc(Br)c5O)c(Br)c4)cc(Br)c3O)c(Br)c2 |t:20|

BDBM50241985

Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(O)c(Oc4c(Br)cc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc4Br)c3)N=O

BDBM50292368

Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(O)c(Oc4ccc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc4Br)c3)N=O

BDBM50241984

Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(Oc4cc(CC(N=O)C(=O)NCCc5cc(Br)c(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O

BDBM50191286

Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(Oc4cc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O

BDBM50150778

Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O |w:29.29|

BDBM50191280

Oc1c(Br)cc2CCNC(=O)CCNC(=O)CCc3ccc(Oc1c2)c(Br)c3

BDBM50191278

Oc1c(Br)cc2CCNC(=O)CCc3ccc(Oc1c2)c(Br)c3

BDBM50292366

Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(OS([O-])(=O)=O)c(Br)c3)cc(Br)c2O)N=O)cc1Br

BDBM50292367

[O-]S(=O)(=O)Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4OS([O-])(=O)=O)c(Br)c3)N=O |w:33.33|