formula stringlengths 2 25 | smiles stringlengths 4 483 |
|---|---|
C21H29N3O5S | CCCN1C(=O)[C@@H]2[C@@H](CCN2C(=O)CC(C)(C)CC(=O)O)N(CC2=CC=CS2)C1=O |
C12H7Cl3O2 | OC1=CC(Cl)=CC=C1OC1=CC=C(Cl)C=C1Cl |
C21H24O9 | CC[C@@H](C)C(=O)O[C@]1(C)C(=O)C2=C(OC3=C(OC(CO)=CC3=O)[C@@H]2C)[C@@](C)(O)C1=O |
C91H145NO45 | C=C[C@](C)(CC/C=C(\C)C(=O)OC[C@H]1O[C@@H](OC(=O)[C@]23CCC(C)(C)C[C@H]2C2=CC[C@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6NC(C)=O)C(C)(C)[C@H]5CC[C@@]4(C)[C@]2(C)C[C@H]3O)[C@H](O[C@@H]2O[C@@H](C)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O[C@@H]4OC[C@... |
C84H117N19O19 | CC[C@H](C)[C@@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@@H](C(=O)N[C@@H](CC2=CNC3=CC=CC=C23)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CC2=CNC3=CC=CC=C23)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C(C)C)NC1=O |
C48H60N6O16 | COC1=CC=C(C[C@@H]2C(=O)N[C@@H](C)C(=O)N(C)[C@H]3CC4=CC=C(C=C4)OC4=CC(=CC=C4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](OC(C)=O)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N2C)N(C)C3=O)C=C1 |
C35H56O10 | C[C@@H]1C[C@H]2O[C@]3(C[C@@]4(C)[C@H]5[C@@H](O)[C@H](O)[C@@H]6C(C)(C)[C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]67C[C@@]57CC[C@]4(C)[C@@H]13)O[C@@H]2C(C)(C)O |
C52H63NO5 | NCCC1=C[C@@H]([C@@H](C=O)CCCCC[C@@H]2C/C=C\[C@H](CO)[C@H](C(=O)O)[C@@]34C[C@@H]5C=C6C=CC=CC6=C[C@@H]5C[C@@H]3CCC3=CC=C(C=C34)C[C@@H]2C2=CC=C(O)C=C2)CC1 |
C14H20O4 | COC1=C(O)C(C)=C(CC=C(C)C)C(O)=C1OC |
C19H30O | CC(=O)C[C@H](C)CCCCCCCCC1=CC=CC=C1 |
C22H34O6 | CC(=O)O[C@@H]1CC[C@@]2(C)C3CC[C@@H]4C[C@@]3([C@@H](O)CC2[C@@]1(C)CO)[C@H]1O[C@@]41CO |
C46H70O18 | CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@@H](O[C@H]3[C@@H](O)C[C@H](O[C@@H]4CC5=CC[C@H]6C(=O)[C@@H](C7=C(C)OC=C7)CC[C@@H]6[C@@]5(C)C[C@H]4O)O[C@@H]3C)C[C@H]2OC)O[C@@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
C29H40N4O3S | CC1=C[C@@H](CNS(=O)(=O)CC2=CC=CC=C2)[C@H](C(C)C)C[C@H]1CC(=O)N1CCN(C2=CC=CC=[NH+]2)CC1 |
C19H23NO6 | COC(=O)[C@H](NC(=O)C(C)OC1=CC=C2C(C)=CC(=O)OC2=C1)C(C)C |
C44H52N4O6 | CCCCC[C@H]1C[C@H](O)CCC2=C(CO)C=C(O)C(=C2)OCC2=CC([C@H](CC(=O)N3CCC3)C3=CC=CC=C3)=CC3=CN(C=C23)C2=NC(N)=CC=C2CO1 |
C20H23ClO7 | C=C(CCl)[C@@H]1CC[C@]23O[C@H]2[C@H](C[C@](C)(O)[C@H](O)C2=CC(C=O)=C(C1)O2)OC3=O |
C42H60N6O11 | CC(C)CCCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)[C@@H]1/C(O)=N/[C@@H](C)/C(O)=N/[C@H](C(=O)O)CC2=CC(=C(O)C=C2)C2=C(O)C=CC1=C2 |
C20H34O2 | C=C1CCCC(C)(C)[C@@H]1CC[C@](C)(O)/C=C/C/C(C)=C/CO |
C27H38N2O6 | C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N/OCC(=O)N[C@H](C(=O)O)[C@@H](C)O)CC[C@]4(C)[C@@H]3CC[C@@]21C |
C18H25NO5 | COC1=CC2=C(CN3C[C@@H](O)[C@]24CC[C@H](OC)C[C@@H]34)C(OC)=C1O |
C21H38N2O17 | N[C@@H]1[C@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](O[C@@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3N[C@H](CO)[C@@H](O)[C@@H]3O)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O |
C38H60O17 | C=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]2CC[C@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C3 |
C34H52O11 | CC1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4[C@H](O)C=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C[C@H](O)[C@]5(C)[C@@H]4CC[C@]23C)C1 |
C48H86NO8P | CCCCCC=CCC=CCC=CCC=CCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCC=CCCCCCC |
C16H26O7 | CCCC(=O)OC[C@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]2OC(C)(C)O[C@H]21 |
C57H60N4O16 | NC1=CC=C([C@@H](O)[C@H](CO)OC2=CC=C(C3=CC(=O)C4=C(O)C(O[C@@]56CCC[C@H]5CCCC5=C(O)C=CC=C56)=C(O[C@@H]5O[C@H](C(=O)O)[C@@]6(O)[C@@H]([C@H]7CNCN7)C7=C(CCC8=CC=C(O)C=C8C7)[C@@]5(O)[C@@H]6O)C=C4O3)C=C2)N1 |
C58H96O16 | CC[C@@H]1[C@@H](C)O[C@@](OC)([C@@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)/C=C/C=C/[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@H](C)[C@@]3(OC)C[C@@H](O[C@H]4C[C@H](O)[C@H](O)[C@H](C)O4)[C@H](CC)[C@@H](C)O3)OC(=O)/C=C/C=C\[C@H]2C)C[C@H]1O[C@H]1C[C@H](C)[C@H](C)[C@H](C)O1 |
C35H36O11 | CC1=C(C(=O)CCC2=CC=CC=C2CCC2=CC=CC=C2)C(O)=C2C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CC(C(=O)O)=CC2=C1O |
C7H14O5 | CCO[C@H]1OC[C@H](O)[C@H](O)[C@H]1O |
C19H35N3O6 | CC(C)C[C@@H](O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCCCC(=O)O |
C55H96O6 | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCC |
C55H104O6 | CCCCCC/C=C\CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC |
C10H9NO | CC1=CC(=O)NC2=CC=CC=C12 |
C20H36N2O3 | CC(C)(C)CC(=O)N1CC[C@@H](CC(=O)O)[C@@H](CCN2CCCCC2)C1 |
C12H18O3 | O=C(O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 |
C14H15NO2 | COC1=CC=CC2=C3O[C@H](C)CC3=C(C)N=C12 |
C36H36O19 | O=C(C=CC1=CC=C(O)C=C1)OC[C@H]1O[C@@H](OC2=CC3=C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O |
C16H14O6 | COC1=CC=C2C(=O)C3=C(OC)C=C(O)C=C3OC2=C1OC |
C26H22O6 | COC1=CC=C(C2=C(CC(=O)O)C3=CC4=C(C=C3O2)OC[C@@H](C2=CC=C(O)C=C2)C4)C=C1 |
C17H17N3O2 | COC1=CC=C(NC(=O)CC2=CN(C)C3=CC=CC=C23)C=N1 |
C30H37NO11 | COC1=CC(/C=C/C(=O)O[C@H]2C[C@@H]3[C@@H](OC(=O)C4=CC(OC)=C(OC)C(OC)=C4)[C@H](O)[C@H](C2)N3C)=CC(OC)=C1OC |
C26H31N4 | C/C=C1\C[N@+]2(C)CC[C@]34C5=CC=CC=C5N[C@@H]3[C@@H](/C=N/NC3=CC=CC=C3)C1C[C@H]42 |
C16H20N2O10S2 | O=S(=O)(O)O/N=C(/CC1=CNC2=CC=CC(O)=C12)S[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O |
C38H69NO8S | CCCCCCCCCCCCCCCC/C=C\CCC#CCCC(=O)O[C@H](C)C[C@@H](O)CCC[C@@](C)(O)CC(=O)NCCS(=O)(=O)O |
C22H35N5O3 | CC(C)NC(=O)N1CC[C@@H](CC(=O)O)[C@@H](CCN2CCN(C3=CC=CC=N3)CC2)C1 |
C30H26O6 | C[C@@]1(C2=CC(O)=CC(O)=C2)C2=C(C=C(O)C=C2/C=C/C2=CC=C(O)C=C2)O[C@@]1(C)C1=CC=C(O)C=C1 |
C21H22O11 | COC1=CC(O)=C2C(=O)C(OC3OC[C@H](O)[C@H](O)C3O)[C@@H](C3=CC=C(O)C(O)=C3)OC2=C1 |
C42H64O5 | CCCCCC[C@@]12CC[C@@]3(C)[C@@H]4[C@@H](O)C[C@]5(O)O[C@H](CC6=CC=CC=C6)[C@@]4(CC[C@@H]3[C@@]1(C)CC[C@@]1(C)CC[C@@](C)(C(=O)O)C[C@H]12)[C@H]5C |
C18H27NO4 | CCCOC1=CC=C(C(=O)CCN[C@@H](C(=O)O)[C@H](C)CC)C=C1 |
C53H102O6 | CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCC(C)C |
C51H84O15 | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC |
C14H25NO11 | CC(=O)N[C@H]1[C@H](O[C@@H]([C@@H](O)[C@H](O)CO)[C@@H](O)C=O)O[C@H](CO)[C@@H](O)[C@@H]1O |
C20H25N3O5S | O=C(NC1CCCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(NC3=CC=C4OCOC4=C3)S[C@@H]21 |
C37H41N3O7 | CC(C)C[C@@H](NC(=O)C1=CC=CC=C1)C(=O)OCC1=C(COC(=O)[C@@H](CC(C)C)NC(=O)C2=CC=CC=C2)OC(C2=CC=CC=C2)=N1 |
C29H22ClNO6 | CC1=C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)C(=O)OC2=CC3=C(C=C12)C(C1=CC=C(Cl)C=C1)=CO3 |
C19H18O7 | COC1=CC(C)=C2C(=O)OC3=C(C)C(O)=C(C(=O)O)C(C)=C3OC2=C1C |
C16H15NO5 | COC1=CC=C(N2C[C@@]34C=C[C@@H](O3)C(C(=O)O)[C@H]4C2=O)C=C1 |
C20H18N4O2 | OC1=CC=C(C2=CC(CC3=NC=CN3)=CC=C2O)C(CC2=NC=CN2)=C1 |
C22H28O4 | COC1=C(C)C(=O)C(C)=C([C@@]2(C)C=C(C)C=C(C)C2/C(C)=C/C(C)=O)O1 |
C13H16O6 | COC1=CC2=C(C(=O)CC[C@@H]2O)C(O)=C1[C@@H](O)CO |
C24H30O12 | CC(=O)C1=C(C)C=C2C=CC=C(O[C@@H]3O[C@H](CO[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)C2=C1O |
C25H34O9 | CC1=CC(=O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](OC(=O)CC(C)C)[C@@H]45 |
C20H28N2O | CC(C)[C@]12CN3C[C@](C(C)C)(C[N@@](C1)[C@@H]3C1=CC=CC=C1)C2=O |
C22H30O9 | C=C[C@@](C)(O)CC/C=C(\C)C(=O)OCC1O[C@@H](OC2=CC=C(O)C=C2)[C@@H](O)C(O)[C@@H]1O |
C28H36O5 | CC(=O)O[C@H]1CC[C@]2(C)[C@H](CC(=O)[C@H]3[C@H]4CC[C@H](OC(=O)C5=CC=CC=C5)[C@@]4(C)CC[C@@H]32)C1 |
C66H128O6 | CCC(C)CCCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCC(C)CC |
C19H23N7O3 | CC1=CC(C(=O)N[C@@H]2C[C@H](CN3C=C(C4=CC=CN=C4)N=N3)[C@@H](O)[C@H]2O)=NN1C |
C39H72O5 | CCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
C39H77NO10 | CCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCC(C)C |
C20H32O3 | C=C1CCC(C(C)C)[C@@H]2C3OC(C[C@@]4(C)O[C@]3(C)CC[C@@H]4O)[C@H]12 |
C23H26ClNO6 | COC1=CC([C@H]2C(C(=O)OC[C@@H]3CCCO3)=C(C)NC3=C2C(=O)CCC3)=CC(Cl)=C1O |
C45H84O5 | CCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC |
C18H21NO5 | CC1=C(O)C=CC2=C1OC(=O)C=C2CN1CCC2(CC1)OCCO2 |
C18H25N5O3 | CC1=NC=CC(O[C@@H]2C(=O)N(C)[C@@H]3CN(C(=O)NC4CCCC4)C[C@H]23)=N1 |
C51H98O6 | CCCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCCCCCC(C)CC |
C36H56O7 | CO/C1=C/C(C)=C/[C@@H](C)[C@@H](O)[C@@H](C)C/C(C)=C/C=C/[C@H](OC)[C@@H]([C@@H](C)/C=C(\C)C2=C[C@@H](OC)[C@H](C)[C@@H](C(C)C)O2)OC1=O |
C53H44S4 | CSC1=CC=C(C2=CC=C(C(C3=CC=C(C4=CC=C(CS)C=C4)C=C3)(C3=CC=C(C4=CC=C(SC)C=C4)C=C3)C3=CC=C(C4=CC=C(SC)C=C4)C=C3)C=C2)C=C1 |
C15H15NO2 | COC1=CC2=C(C=C1C)C1=CC=CC(OC)=C1N2 |
C18H28O5 | C[C@H]1C=CC2=CCC[C@H](O)[C@@H]2[C@@H]1CC[C@@H](O)C[C@@H](O)CC(=O)O |
C38H56O9 | C/C=C(\C)C(=O)O[C@@H]1C[C@]2(C)C(=CC[C@H]2[C@@H]2C[C@@H]([C@@H]3OC3(C)C)O[C@H]2OC)[C@]2(C)[C@H](OC(C)=O)C[C@H]3C(C)(C)C(=O)C[C@H](O)[C@]3(C)[C@@H]12 |
C53H82O21 | C=C(C)CCC[C@]1(C)OC(=O)[C@]23CC=C4C(CCC5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](C)[C@@H](O[C@@H]7OC[C@@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](OC)[C@H]8O)[C@H]7O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]2(C)CC(=O)C31 |
C12H10ClN3O | O=C(NC1=CC=CC=C1)NC1=CC=NC(Cl)=C1 |
C25H36O6 | CC(C)=C[C@H]1C[C@H](C)[C@H]2CC[C@H](C)C3=C2C1=C(C)C(O)=C3O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O |
C38H54O19 | CC(/C=C/C=C(\C)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(O)[C@H](O)C1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
C30H26O6 | COC1=CC(OC2=CC3=C(C(OC)=C2)C2=CC=C(O)C=C2CC3)=C2CCC3=CC(O)=CC=C3C2=C1O |
C20H28O3 | CC1=CCC[C@@H]2[C@](C)(CCC3=COC=C3)[C@H](C(=O)O)CC[C@@]12C |
C12H16N2O | COC1=CC=C2NC=C(CN(C)C)C2=C1 |
C30H48O4 | CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]2C1 |
C18H16O8 | COC1=CC(O)=C(C2=CC(=O)C3=C(O)C=C(O)C(OC)=C3O2)C=C1OC |
C30H39NO7 | CC1=CC(=O)[C@H]2[C@@H](C1)[C@]13CO[C@@]4([C@H]1O)N1C[C@H]5C[C@H](C)C[C@]1(CC[C@@]4(C)[C@]1(COC(=O)C1)[C@H]3C(=O)[C@@H]2C)O5 |
C29H41N3O4 | C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)N[C@@H]5CCCCNC5=O)CC[C@]4(C)[C@@H]3CC[C@@]21C |
C34H52O10 | COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@H]4[C@H]5C(=O)C(O)=C([C@H](C)CC(=O)CC(C)C)[C@@]5(C)CC[C@@H]43)C2)[C@H](O)[C@@H](O)[C@@H]1O |
C23H23NO7 | CCC[C@@H](NC(=O)COC1=CC=C2C(C3=CC=C(OC)C=C3)=CC(=O)OC2=C1)C(=O)O |
C32H34O4 | COC1=CC=C(CC2=C(OC)C=C(OC)C(CC3=CC=C(OC)C=C3)=C2CCC2=CC=CC=C2)C=C1 |
C19H30N4O5 | COC1=CC=CC(NC(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2N2CCN(C)CC2)=C1 |
C24H22N2O6 | CC1=C(C)C2=CC=C(OCC(=O)N[C@@H](CC3=CNC4=CC=CC=C34)C(=O)O)C=C2OC1=O |
C29H44O4 | C[C@@H]1C(=O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5[C@H](O)C(C)(C)CC[C@]5(C(=O)O)CC[C@@]4(C)[C@]3(C)CC[C@@H]12 |
C22H42O10 | O=C(O)C(O)CCCCCCCCCCCCC(O)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
C36H41NO8 | COC1=CC=C(CNC(=O)CC(C2=CC=C(OC)C=C2)C2=C(O)C=C3/C=C/CCCC(=O)CCC[C@H](C)OC(=O)C3=C2O)C=C1 |
C54H84O21 | CC1=C(O)C(=O)C[C@H](O[C@@H]2CC(C)(C)C[C@H]3C4=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]7O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]4(C)CC[C@@]23C)O1 |
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