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  1. 1 - 14
Compound 1
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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Compound 4
Drug synonym:Not Available
Molecular Weight:321.797
Molecular Formula:C14H24ClNO5
SMILES:COCCOCCOCCNC(=O)\C=C\CCCC(Cl)=O
InChI:1S/C14H24ClNO5/c1-19-9-10-21-12-11-20-8-7-16-14(18)6-4-2-3-5-13(15)17/h4,6H,2-3,5,7-12H2,1H3,(H,16,18)/b6-4+
InChIKey:VAUIYSSLXHOJCY-GQCTYLIASA-N
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Compound 5
Drug synonym:Not Available
Molecular Weight:377.903
Molecular Formula:C18H32ClNO5
SMILES:COCCOCCOCCNC(=O)\C=C\CCCCCCCC(Cl)=O
InChI:1S/C18H32ClNO5/c1-23-13-14-25-16-15-24-12-11-20-18(22)10-8-6-4-2-3-5-7-9-17(19)21/h8,10H,2-7,9,11-16H2,1H3,(H,20,22)/b10-8+
InChIKey:GMVFBECLNXPNLF-CSKARUKUSA-N
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Compound 6
Drug synonym:Not Available
Molecular Weight:434.01
Molecular Formula:C22H40ClNO5
SMILES:COCCOCCOCCNC(=O)\C=C\CCCCCCCCCCCC(Cl)=O
InChI:1S/C22H40ClNO5/c1-27-17-18-29-20-19-28-16-15-24-22(26)14-12-10-8-6-4-2-3-5-7-9-11-13-21(23)25/h12,14H,2-11,13,15-20H2,1H3,(H,24,26)/b14-12+
InChIKey:BSVFPZCAJFZGOI-WYMLVPIESA-N
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Compound 1b
Drug synonym:Not Available
Molecular Weight:864.556
Molecular Formula:C48H26Cl4N4O4
SMILES:ClC(=O)C1=CC=CC(=C1)C1=C2\C=CC(=N2)\C(=C2/N\C(\C=C2)=C(/C2=N/C(/C=C2)=C(\C2=CC=C\1N2)C1=CC(=CC=C1)C(Cl)=O)C1=CC(=CC=C1)C(Cl)=O)\C1=CC(=CC=C1)C(Cl)=O
InChI:1S/C48H26Cl4N4O4/c49-45(57)29-9-1-5-25(21-29)41-33-13-15-35(53-33)42(26-6-2-10-30(22-26)46(50)58)37-17-19-39(55-37)44(28-8-4-12-32(24-28)48(52)60)40-20-18-38(56-40)43(36-16-14-34(41)54-36)27-7-3-11-31(23-27)47(51)59/h1-24,53,56H/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-
InChIKey:FSCMVIUQJCENRA-LWQDQPMZSA-N
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Compound 2
Drug synonym:Not Available
Molecular Weight:972.811
Molecular Formula:C40H24N2Na4O14S4
SMILES:[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)C1=CC2=C(C=C1)C(=NC1=CC=C(C=C1)C1=CC=C(C=C1)N=C1C3=CC=C(C=C3C(=O)C3=C1C=C(C=C3)S([O-])(=O)=O)S([O-])(=O)=O)C1=CC(=CC=C1C2=O)S([O-])(=O)=O
InChI:1S/C40H24N2O14S4.4Na/c43-39-31-15-11-25(57(45,46)47)17-33(31)37(29-13-9-27(19-35(29)39)59(51,52)53)41-23-5-1-21(2-6-23)22-3-7-24(8-4-22)42-38-30-14-10-28(60(54,55)56)20-36(30)40(44)32-16-12-26(18-34(32)38)58(48,49)50;;;;/h1-20H,(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4
InChIKey:AYRQLDLOAAGBSE-UHFFFAOYSA-J
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Compound 3
Drug synonym:Not Available
Molecular Weight:1071.585
Molecular Formula:C68H52ClMnN8
SMILES:C[N+]1=C(C=CC=C1)C1=CC=C(C=C1)C1=C2\C=C/C3=C(/C4=N/C(/C=C4)=C(\C4=CC=C(N4[Mn](Cl)N2\3)\C(=C2\C=CC\1=N2)C1=CC=C(C=C1)C1=[N+](C)C=CC=C1)C1=CC=C(C=C1)C1=[N+](C)C=CC=C1)C1=CC=C(C=C1)C1=[N+](C)C=CC=C1
InChI:1S/C68H52N8.ClH.Mn/c1-73-41-9-5-13-61(73)45-17-25-49(26-18-45)65-53-33-35-55(69-53)66(50-27-19-46(20-28-50)62-14-6-10-42-74(62)2)57-37-39-59(71-57)68(52-31-23-48(24-32-52)64-16-8-12-44-76(64)4)60-40-38-58(72-60)67(56-36-34-54(65)70-56)51-29-21-47(22-30-51)63-15-7-11-43-75(63)3;;/h5-44H,1-4H3;1H;/q+2;;+3/p-1
InChIKey:GQZZQNSAIIKOHU-UHFFFAOYSA-M
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Compound 1a
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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Compound 7
Drug synonym:Not Available
Molecular Weight:412.302
Molecular Formula:C14H8Na2O8S2
SMILES:[Na+].[Na+].[O-]S(=O)(=O)C1=CC2=C(C=C1)C(=O)C1=CC(=CC=C1C2=O)S([O-])(=O)=O
InChI:1S/C14H8O8S2.2Na/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)10-4-2-8(6-12(10)13)24(20,21)22;;/h1-6H,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2
InChIKey:PKOVWEHDVFYKHL-UHFFFAOYSA-L
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Compound 2a
Drug synonym:Not Available
Molecular Weight:976.843
Molecular Formula:C40H28N2Na4O14S4
SMILES:[Na+].[Na+].[Na+].[Na+].OC1C2=CC(=CC=C2C(=NC2=CC=C(C=C2)C2=CC=C(C=C2)N=C2C3=CC(=CC=C3C(O)C3=C2C=CC(=C3)S([O-])(=O)=O)S([O-])(=O)=O)C2=C1C=CC(=C2)S([O-])(=O)=O)S([O-])(=O)=O
InChI:1S/C40H28N2O14S4.4Na/c43-39-31-15-11-25(57(45,46)47)17-33(31)37(29-13-9-27(19-35(29)39)59(51,52)53)41-23-5-1-21(2-6-23)22-3-7-24(8-4-22)42-38-30-14-10-28(60(54,55)56)20-36(30)40(44)32-16-12-26(18-34(32)38)58(48,49)50;;;;/h1-20,39-40,43-44H,(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4
InChIKey:MGZBTTBMTMMJPP-UHFFFAOYSA-J
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Compound 8
Drug synonym:Not Available
Molecular Weight:767.201
Molecular Formula:C44H36ClMnN8
SMILES:C[N+]1=CC=CC(=C1)C1=C2\C=C/C3=C(/C4=N/C(/C=C4)=C(\C4=CC=C(N4[Mn](Cl)N2\3)\C(=C2\C=CC\1=N2)C1=C[N+](C)=CC=C1)C1=C[N+](C)=CC=C1)C1=C[N+](C)=CC=C1
InChI:1S/C44H36N8.ClH.Mn/c1-49-21-5-9-29(25-49)41-33-13-15-35(45-33)42(30-10-6-22-50(2)26-30)37-17-19-39(47-37)44(32-12-8-24-52(4)28-32)40-20-18-38(48-40)43(36-16-14-34(41)46-36)31-11-7-23-51(3)27-31;;/h5-28H,1-4H3;1H;/q+2;;+3/p-1/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;
InChIKey:WRQVFTPJOKHUET-YKKPBKTHSA-M
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Compound 9
Drug synonym:Not Available
Molecular Weight:238.2414
Molecular Formula:C14H10N2O2
SMILES:NC1=CC2=C(C=C1)C(=O)C1=CC(N)=CC=C1C2=O
InChI:1S/C14H10N2O2/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6H,15-16H2
InChIKey:WQOWBWVMZPPPGX-UHFFFAOYSA-N
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Compound 10
Drug synonym:Not Available
Molecular Weight:376.511
Molecular Formula:(CH2)nC16H30N2O5S
SMILES:Not Available
InChI:1S/C17H32N2O5S/c1-22-11-12-24-14-13-23-10-8-18-16(20)6-4-2-3-5-7-17(21)19-9-15-25/h4,6,25H,2-3,5,7-15H2,1H3,(H,18,20)(H,19,21)/b6-4+
InChIKey:XCRGHQYYQGBIGW-GQCTYLIASA-N
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Compound 11
Drug synonym:Not Available
Molecular Weight:975.312
Molecular Formula:C56H54N4O4S4
SMILES:SCCCOC1=CC(=CC=C1)C1=C2\C=CC(=N2)\C(=C2/N\C(\C=C2)=C(/C2=N/C(/C=C2)=C(\C2=CC=C\1N2)C1=CC(OCCCS)=CC=C1)C1=CC(OCCCS)=CC=C1)\C1=CC=CC(OCCCS)=C1
InChI:1S/C56H54N4O4S4/c65-29-5-25-61-41-13-1-9-37(33-41)53-45-17-19-47(57-45)54(38-10-2-14-42(34-38)62-26-6-30-66)49-21-23-51(59-49)56(40-12-4-16-44(36-40)64-28-8-32-68)52-24-22-50(60-52)55(48-20-18-46(53)58-48)39-11-3-15-43(35-39)63-27-7-31-67/h1-4,9-24,33-36,57,60,65-68H,5-8,25-32H2/b53-45-,53-46-,54-47-,54-49-,55-48-,55-50-,56-51-,56-52-
InChIKey:LWYBJLTVIXLVSP-YFLSTINXSA-N
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