formula
stringlengths 1
25
| smiles
stringlengths 1
660
|
|---|---|
C41H66O16S.Na
|
CC(C)CCC[C@]1(C)OC(=O)[C@]23[C@@H](O)C=C4C(CCC5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](OS(=O)(=O)[O-])[C@H](O)[C@H]6O[C@@H]6O[C@H](C)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]2(C)CC[C@@]31O.[Na+]
|
C46H67NO4
|
C[C@@]1(O)[C@@H]2CC[C@H](CC[C@H](CCC3=CC=CC=C3)C3=CC=C(CCCO)C=C3)CN2C[C@H]2[C@H]3C[C@H]4[C@@H](C[C@H](O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]21
|
C29H22O11
|
CO[C@@]12C3=C(C)C=C(O)C4=C3C(=COC4=O)C(=O)[C@H]1[C@@]13COC(=O)C4=C(O)C=C(C)C(=C41)C(=O)[C@@H]2[C@@H]3OC(C)=O
|
C24H25N3O7S
|
COC(=O)C1=CC=CC(NC(=S)N[C@H]2CO[C@H]3[C@@H]2OC[C@H]3OC(=O)NC2=CC=CC(C(C)=O)=C2)=C1
|
C30H30N2O5S
|
CC1=CC=C(C)C(CN2C(=O)C3=CC=CC=C3[S@+]([O-])C3=CC=C(C(=O)N4CCC5(CC4)OCCO5)C=C32)=C1
|
C62H73N5O7
|
CNC[C@H]1[C@H]2C3=C(C=CN3)[C@@H]3CC(=O)C[C@H]4NC[C@H]([C@@H]2[C@H]43)C2(CCCC2)[C@@H]1[C@@H]1CC[C@]2(C#C[C@H](C[C@H](O)[C@H](O)C[C@H](C3=CC=NC(N)=C3)C3=CC=C4C=CC=CC4=C3)C3=CC(O)=C(OC)C=C3CCC2=O)[C@H](O)C1
|
C18H20BrN2O.HI
|
C[N+]1=CC=CC([C@@H]2CCCCN2C(=O)C2=CC=CC=C2Br)=C1.[I-]
|
C23H37N3O2S
|
C=CCNC1=NC2=C(C[C@]3(C)CC[C@@H]([C@H](C)C(=O)N(CC)CC)[C@H](O)[C@H]3[C@@H]2C)S1
|
C10H16N4O7
|
NC1=NC(=O)C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C(N)N1
|
C19H22O7
|
CC(C)[C@H]1OC(=O)C=C2[C@]3(C)[C@H]4[C@H](OC(=O)[C@@]4(C)[C@@H](O)[C@H]4O[C@H]43)[C@H]3O[C@]213
|
C39H44O18
|
COC1=CC2=C(CC1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](COC(=O)/C=C/C3=CC(OC)=C(O)C(OC)=C3)[C@@H](O)[C@H](O)[C@H]1O)C(=O)C=C(C1=CC=C(O)C=C1)O2
|
C37H46N6O11
|
N[C@@H](CCCCNC(=O)CNC(=O)C1=CC=CC(O)=C1O)C(=O)N[C@@H](CCCCNC(=O)C1=CC=CC(O)=C1O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)O
|
C23H25N5O2S
|
COC1=CC=CC(NC(=O)[C@@H]2SC3=NN=C(C4=CC=CC=C4)N3NC23CCCCC3)=C1
|
C39H58O11
|
CC(=O)O[C@@H]1[C@@H](O)[C@H](O[C@H]2CC[C@]34C[C@]35C[C@@H](OC(C)=O)[C@]3(C)[C@H]6[C@H](C)C[C@@]7(OC[C@]8(C)O[C@H]78)O[C@H]6C[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H]1O
|
C22H21ClO6
|
COC1=CC(COC2=CC3=C(C=C2Cl)C2=C(CCC2)C(=O)O3)=CC(OC)=C1OC
|
C32H52N4O5
|
CNC(=N)NC[C@@H]1C[C@H]([C@H](O)C[C@@H](CCC2=CC=C(O)C(O[C@H]3CCNC4(CCCC4)C3)=C2)OC(C)=O)CC[C@H]1C
|
C24H25N5O7
|
C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC1=CC=CC=C1)N1C(O)=NC2=CC=CC=C2C1=O)C(=O)O
|
C9H7ClO2
|
Cl[C@@H]1CC2=CC3=C(C=C21)OCO3
|
C14H17N3O
|
NC1=C2C=CC=CC2=NC(=O)N1C1CCCCC1
|
C12H17N3O3
|
N[C@H](C=O)CCC(=O)NNC1=CC=C(CO)C=C1
|
C48H54N2O13S
|
C[C@]12C[C@@]34C=CC(=O)[C@@](C)(CCC(=O)NC5=C(O)C=CC(C(=O)S[C@H]6CC(=O)[C@@](C)(CCC(=O)NC7=C(O)C=CC(C(=O)O)=C7O)[C@@H]7[C@@H]8C[C@@H]9C[C@]67C[C@]9(C)O8)=C5O)[C@@H]3[C@H](C[C@@H]1C4)O2
|
C13H24NO.HI
|
C[N+]1(C2CCC3CCC2[C@@H]3O)CCCC1.[I-]
|
C11H10N4OS
|
COC1=CC=C(C2=NN3C(C)=NN=C3S2)C=C1
|
C25H25ClN4O4
|
CC1=C(Cl)C=CC2=C1N=C(O)C21NC(CCC(N)=O)[C@H]2C(=O)N([C@H](C)C3=CC=CC=C3)C(=O)[C@H]21
|
C31H38ClN3O14
|
COC1=CC(O)=C2C(=O)C3=C(O)[C@]4(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]4(O)C[C@@H]3[C@@](C)(O[C@H]3C[C@](C)([N+](=O)[O-])[C@@H](OC)[C@H](C)O3)C2=C1Cl
|
C26H23N3O7
|
COC1=CC=C(C(=O)N/C(=C\C2=CC=C([N+](=O)[O-])C=C2)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)C=C1
|
C51H51NO8S4
|
CC(C)CC1=CC(C2=C(O)C(=O)C3=C4O[C@@H]5C[C@H]6C7=C(C=CC8=CC=CC(=C78)[C@@H](SSCCC[C@H]5O)[C@H]6O)C4=C(O)C=C3O2)=C2CSS[C@H]3CCCN[C@H]3C3=CC=CC(=C3)CC2=C1O
|
C13H22N2O5S
|
CO[C@@H]1C(=O)N(C)[C@@H]2CN(S(=O)(=O)C3CCOCC3)C[C@H]12
|
C66H107NO28
|
CC(=O)N[C@H]1[C@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC5OCC(O)C(O)C5O)CC[C@]34C)C2(C)C)O[C@H](COC2OC(C)C(O)C(OC3OCC(O)C(OC4OC(C)C(O)C(OC5OC(C)C(O)C(O)C5O)C4O)C3O)C2O)[C@@H](O)[C@@H]1O
|
C36H54O21
|
CCO[C@@H]1C[C@@H]2C(C(=O)OC)=CO[C@@H](O[C@@H]3O[C@H](CO[C@H]4C[C@@H]5C(C(=O)OC)=CO[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H]5[C@H](C)O4)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2[C@H](C)O1
|
C30H28ClNO10
|
COC(=O)CC(C1=C(O)[C@@]2(OC3=C(Cl)C(OC)=CC(OC)=C3C2=O)[C@H](C)CC1=O)C1=CC2=CC(OC)=CC=C2NC1=O
|
C25H36INO3
|
CC1(C)O[C@]2(CC[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@H]4CC[C@@]32C)CN1C(=O)CI
|
C33H27ClN4O10
|
COC1=CC(OC)=C2C(=O)[C@@]3(OC2=C1Cl)C(=O)C1=C(C[C@H]3C)NC2=C(C(=O)N(C)C(=O)N2C)C1C1=CC2=CC3=C(C=C2NC1=O)OCO3
|
C56H72N2O10
|
CC1(C)O[C@H]2C3(CCCC3)C(=O)OC[C@@]23[C@@H]1C(=O)[C@@H](O)[C@]1([C@H]2CCC[C@@H](CC4=CC=CC=C4)C2)[C@@H]3CC[C@@]2(C)[C@H](C3=C(C[C@H](CO)[C@H]4CC[C@H]5[C@H](C=CN6CNC[C@H]56)C4)OC=C3)OC(=O)[C@H]3O[C@@]312
|
C14H14O2S
|
OC1=CC=C(CSCC2=CC=C(O)C=C2)C=C1
|
C24H24Cl2N4O4
|
O=C(NCCOCCOCCNC(=O)C1=CC2=CC(Cl)=CC=C2N1)C1=CC2=CC(Cl)=CC=C2N1
|
C37H28N2O9
|
O=C(N1CCC2=CC3=C(OCO3)C3=C2[C@@H]1CC1=CC=C2OCOC2=C13)N1CCC2=CC3=C(OCO3)C3=C2[C@@H]1CC1=CC=C2OCOC2=C13
|
C9H11BrN2O
|
NCCC(=O)C1=CC=C(Br)C=C1N
|
C36H56O31S
|
O=S(=O)(O)O[C@@H]1[C@H](O[C@@H]2O[C@H]3CO[C@@H]([C@@H]2O)[C@@H]3O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H]4CO[C@@H]([C@@H]3O)[C@@H]4O)[C@H]2O)[C@@H](O)[C@H](O[C@H]2[C@H]3OC[C@@H]2O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[C@@H]2O)[C@H]3O)O[C@@H]1CO
|
C17H14N3O2
|
O=[N+]([O-])C1=CC=CC=C1C[N+]1=CC=CC=C1C1=CC=CC=N1
|
C24H19Cl2N3O4
|
COC1=CC=CC=C1OC1=CN=C(N)N=C1C1=CC=C(OCC2=CC=C(Cl)C=C2Cl)C=C1O
|
C14H24N2O6S
|
COC(=O)CCCC[C@H]1SC[C@@H](NC(=O)OC)[C@H]1NC(=O)OC
|
C38H51N3O7
|
NC1=CC([C@H](CC2=CC=CN2)[C@@H]2CC[C@H](O)[C@H](O)[C@H]2OC2=CC(CC[C@@H](O)[C@H]3CC#C[C@H](CCO)CCCC[C@@H]3O)=CC=C2O)=CC=N1
|
C23H32O3S
|
CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]34CCO4)[C@H]12
|
C43H78N6O13
|
CCCCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1NC(C)=O)C(N)=O)C(=O)O
|
C14H20Br2O3
|
O=C1CC[C@@H]([C@H](O)/C=C/CCCCCC=C(Br)Br)O1
|
C27H47N5O7S
|
CCCCC[C@H](CC(N)=O)C(=O)N1NCCC[C@H]1C(=O)N[C@H](C(=O)CCSC[C@@H](NC(C)=O)C(=O)O)[C@@H](C)CC
|
C38H32ClN3O2P.ClHO4
|
O=C1C=CC=C2[C@@H]3C[C@@H](CN(C4=C([P+](C5=CC=CC=C5)(C5=CC=CC=C5)C5=CC=CC=C5)N=C(C5=CC=C(Cl)C=C5)O4)C3)CN21.[O-][Cl+3]([O-])([O-])[O-]
|
C23H27N5O4S
|
CC(C)(C)C1=CC=NC(N[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3NS(=O)(=O)C2=CC=CC3=CC=CN=C23)=N1
|
C18H24N4O6
|
COC(=O)[C@H](NC(=O)C1=C[C@@H](NC(=O)C2=CN=CC=N2)[C@@H](O)[C@H](O)C1)C(C)C
|
C17H13N5O5
|
CC1=NN(C(=O)C2=CC=CC=C2O)C(=O)[C@H]1N=NC1=CC=C([N+](=O)[O-])C=C1
|
C38H47NO16
|
CC(=O)O/C1=C(\C)[C@H]2O[C@@](C)([C@@H]3O[C@H]3C(C)(C)[C@@H](OC(C)=O)[C@H]1OC(C)=O)[C@@H](OC(C)=O)[C@]1(OC(C)=O)[C@@H]2[C@@H](OC(=O)C2=CC=CN=C2)[C@@H](C)[C@@H]1OC(C)=O
|
C6H9NOS2
|
C[S@+]([O-])/C=C/CCN=C=S
|
C12H7Cl2NO3
|
O=[N+]([O-])C1=CC=C(OC2=CC=C(Cl)C=C2Cl)C=C1
|
C46H59N6O15P.2Na
|
CCC(C)[C@@H]1/N=C(\O)C(CC2=CC=C([O-])C=C2)N(C)C(=O)[C@H](CC2=CC=CC=C2)N2C(=O)C(CC[C@H]2O)/N=C(\[O-])[C@H](CC2=CC=CC=C2)/N=C(/O)[C@@H](NC(=O)[C@@H](O)COP(=O)(O)O)C(C)OC1=O.[Na+].[Na+]
|
C16H24O3
|
CCCCCC/C=C/[C@@H]1CC2=C(CC[C@H](O)C2=O)O1
|
C9H21N3
|
C1CCNCCNCCNCC1
|
C8H13N3O4
|
CCO/N=C(\C=C\[C@H](C)[N+](=O)[O-])C(N)=O
|
C19H30N4O3
|
CC(=O)N1CCC(N[C@@H]2C[C@@H](O)[C@H](CO)[C@H]2CC2=CC=NC(C)=N2)CC1
|
C33H45NO6
|
CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)/C=C/C7=CC=CC=C7)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14
|
C25H34N2O4S2
|
C=C1/C=C\C(CCC)=C\C2=CSC(=N2)[C@@H](C)NC(=O)C[C@]2(CC(=O)O)CC[C@](C)(O)[C@@H](C1)S2
|
C40H54N2O13S2
|
CC(=O)C1=C(C)C(O)=C2C=C(C(=O)O)C=C(O[C@@H]3O[C@H](CO)[C@]4(CC[C@@]56C[C@]7(CCC[C@@H]7NN5)C[C@H]5COC[C@](CCCO)(CSSCO4)[C@H]56)[C@H](O)[C@H]3O)C2=C1O
|
C80H93N5O10
|
CCC[C@H]1[C@H]2C[C@H]3C[C@@H]4C#C[C@@H](C5=CC(O)=C(OC)C=C5CCC(=O)[C@H](O)C(=O)[C@@H]4C2)C2=CC=CC=C2[C@@H]2C[C@@H](C)[C@H](CC4=CC=CC(O)=C4CO)[C@@H](C#C[C@H](CNC)[C@@H]3C3=CC=NC(=C3)NC3=CC=C4C=CC(=C(O)C4=C3)C[C@@H](O)CNC[C@@H](C)C3=CNC(=C3)C[C@H]1O)C2
|
C45H65N3O11
|
COCCCO[C@H]1CC[C@@]2(C)[C@@H](C1)C(=O)C=C1[C@]3(O)CC[C@@H]4[C@](C)(O)C(O)(O)[C@H]5O[C@H]6[C@H]([C@@H]7C=CC6(O)N[C@@H]7C(=O)N6C[C@H]6CC#C[C@]12CC[C@]43C)[C@H]5CNC[C@H](C)O
|
C15H17N3S
|
CC1=C(C)C[C@@H](C2=CN(C3=CC=CC=C3)N=N2)SC1
|
C56H97N2O49P
|
CC(=O)N[C@H]1[C@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H]([C@@H](O)CO)O[C@H](O[C@@H]4[C@H](O)[C@@H](O[C@@H]5[C@H](O)[C@H](O)[C@@](O)(C(=O)O)O[C@@H]5[C@@H](O)CO)O[C@H]([C@@H](O)CO[P@@](=O)(O)OCCN)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@@H]2CO)O[C@H](CO)[C@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
|
C50H76N6O7
|
CNC[C@H](NC[C@H](C)O)[C@@H]1C2=C(CC[C@H]3CCC[C@@H]31)NC([C@@H](O)COC1=CC(CCC3=CC(CO)=C(CCCCCC[C@H](N)CC[C@H](O)CCC4=CC=NC(N)=C4)O3)=CC=C1O)=C2
|
C18H26N2O5
|
COC(=O)[C@@H](NC(=O)N1CCC2=CC(OC)=C(OC)C=C2C1)C(C)C
|
C22H12Br2
|
BrC1=CC=C2C=CC3=CC=C4C=CC5=CC=C(Br)C=C5C4=C3C2=C1
|
C25H43NO5S
|
CCCCC[C@@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N[C@]1(C)CCS(=O)(=O)C1
|
C32H55N5O7
|
CC[C@@H](C)[C@]1(C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)OC(=O)CCNC(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)CC)N(C)C1=O
|
C2Br3N
|
N#CC(Br)(Br)Br
|
C18H18N6O18
|
COC(=O)C(C(=O)OC)(C1=NC(C(C(=O)OC)(C(=O)OC)[N+](=O)[O-])=NC(C(C(=O)OC)(C(=O)OC)[N+](=O)[O-])=N1)[N+](=O)[O-]
|
C64H100O29
|
C/C=C(\C)C(=O)O[C@H]1[C@@H](OC(C)=O)C(C)(C)C[C@@H]2[C@]13[C@@H](OC(=O)CC)C[C@]1(C)[C@@]4(C)CC[C@H]5C(C)(C)[C@H](O[C@H]6O[C@@H](C(=O)O)[C@H](O)[C@@H](O[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@H]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)CC[C@@]5(C)[C@H]4CC[C@@]21O[C@@H]3O
|
C11H8N2O2
|
OC1=CC=C2NC3=C(O)N=CC=C3C2=C1
|
C32H39NO9
|
CCC(=O)O[C@H]1C[C@H]2[C@](C)(COC(C)=O)[C@@H](OC(C)=O)CC[C@]2(C)[C@H]2CC3=C(C=C(C4=CC=CN=C4)OC3=O)O[C@]12C
|
C26H33ClN2O6
|
CC[C@@H](C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1CCC[C@H](N)C(=O)O
|
C31H34ClNO5
|
C[C@@H](OC1=CC=C2C3=C(CCCC3)C(=O)OC2=C1)C(=O)N1CC[C@@]2(O)CCCC[C@H]2[C@@H]1C1=CC=C(Cl)C=C1
|
C51H68O6
|
CC1(C)C(=O)[C@H](C2=CC=CC(O)=C2)C[C@]2(C)[C@@H]1CC[C@@]1(C)[C@@H]2CCC2=C([C@@H](C[C@@H](O)[C@@H]3O[C@]3(C)[C@@H]3CCC[C@@H]3C3=CC=CC(O)=C3)C3CCCCC3)C(=O)C[C@@]21C
|
C41H58N2O9
|
CNCC[C@@H]1CC[C@H]([C@H](O)CCCO)[C@H](C2=CC([C@H]3CC[C@H]4[C@H](C3)O[C@H](C3=C(CO)C(O)=C(O)C(OC)=C3CC3=CN=CC3)C[C@@H]4O)=CC=C2O)C1
|
C3H9O5P
|
C[C@H](CO)OP(=O)(O)O
|
C35H27BrN2O5
|
COC1=CC=CC(C(=O)[C@@H]2[C@@H](C(=O)C3=CC=C(OC)C(Br)=C3)N3C=CC4=CC=CC=C4[C@@H]3[C@]23C(O)=NC2=CC=CC=C23)=C1
|
C27H37N5O3
|
CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CC[C@@H]1NC(=O)N(CCC2=CNC3=CC=CC=C23)C1=O
|
C39H44N2O5
|
CCOC1=CC=C([C@H]2N[C@H](C3=CC=C(OCC)C=C3)C3C(=O)C2[C@H](C2=CC=C(OCC)C=C2)N[C@H]3C2=CC=C(OCC)C=C2)C=C1
|
C20H25ClN4
|
ClC1=CC=C(C2=NN3C(=N2)N[C@H]2CCCC[C@H]2C32CCCCC2)C=C1
|
C34H41N7O8
|
O=C1CNC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2CCCN2C(=O)CN1
|
C47H72N8O9
|
CCC(C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)CC)NC1=O
|
C23H17ClO5
|
COC1=CC=C(OC2=COC3=CC(OCC4=CC=CC(Cl)=C4)=CC=C3C2=O)C=C1
|
C59H69N3O4
|
C[C@@H]1CC2=C3[C@H]4C5=C6C=C(CC7=CC(=CC=C7)CCCC[C@H]7[C@]68C(=O)O/C(=C\C[C@@H](CC6CCCCC6)[N@@]6CC9C[C@@H](C6)[C@H](C=C2)N3C9)[C@@]8(CC5)[C@]72OC(=O)C3=C(CCCN)C=CC=C32)[C@@H]41
|
C11H10
|
C1=CC2=CC=CC=C2C=CC1
|
C31H20Cl2N2O6
|
O=C(OC1=CC=CC=C1)C1=CC2[C@H]3C(=O)N(C4=CC=CC=C4Cl)C(=O)[C@H]3C1[C@H]1C(=O)N(C3=CC=CC=C3Cl)C(=O)[C@@H]21
|
C71H90O7
|
CC(=O)O[C@@H]1C[C@@H](C)[C@](O)(CCC2=CC(=O)OC2)[C@@]2([C@@H](O)CC[C@H](C)CCCC3=CC=CC=C3)[C@@H](O)CC[C@@](C)([C@@H]3CC[C@]45CC6(CCCC6)[C@H]6C[C@]7(C8=CC=CC=C8)CCCC[C@@H]7C7=CC=C8C=CC=C(C8=C7[C@H]64)[C@@H]5C3)[C@H]12
|
C26H35NO5
|
CC[C@@H]1CC[C@H](C2=CNC=C2)[C@@H]([C@H](CC(=O)CCC2=CC=C(O)C(OC)=C2)OC(C)=O)C1
|
C18H16ClNO4
|
COC1=CC(C[C@@H]2C(=O)NC3=CC(Cl)=CC=C32)=CC2=C1OCCO2
|
C48H72N10O13
|
CO[C@@H](CC1=CC=CC=C1)[C@@H](C)/C=C(C)/C=C/[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@H](C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=O)N(C)C(=O)CC[C@H](C(=O)O)NC(=O)[C@H]1C
|
C54H78N4O9
|
C[C@H]1CCC2=CC[C@@H]3[C@@H](C[C@@H]([C@H]4COC(=O)[C@H]4C4=CNC=C4)C#C[C@H](CCCO)[C@@H]4C[C@@]5(O)C6=CC(=O)[C@@H]7C[C@@H](O)[C@@H](O)C[C@]7(C)[C@H]6CC[C@]5(CCN=C(N)N)[C@H]4[C@@](C)(O)[C@H](O)C[C@H]3C)[C@@H]2C1
|
C48H94O11
|
CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCC(C)C)O[C@@H]1O[C@@H](CO)[C@H](OC2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H]1O
|
C55H86O21
|
CO[C@H]1C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@@H]3[C@H](C)O[C@@H](O[C@H]4[C@@H](OC)C[C@H](O[C@@H]5CC6=CC[C@H]7C(=O)O[C@@H]8CO[C@]9(C)OC=C(CC[C@@H]7[C@@]6(C)C[C@H]5O)[C@H]89)O[C@@H]4C)C[C@H]3OC)O[C@@H]2C)O[C@H](C)[C@H]1O[C@H]1C[C@@H](OC)[C@@H](O)[C@H](C)O1
|
C38H48O12
|
C/C=C(\C)C(=O)O[C@H]1[C@@H](OC(C)=O)[C@@]2(O)O[C@]1(C)C=C1[C@H](OC(=O)C3=CC=CC=C3)[C@@H](C)C[C@@]1(OC(C)=O)[C@H](OC(C)=O)[C@@H](C)/C=C/C2(C)C
|
C103H177N5O55
|
CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H]3CC(C)=O)[C@H](O[C@]3(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@@H](CO)O[C@]4(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@@H](CO)O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCC
|
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