[(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate

C156H242F7N21O78P12S — CID 172942335

About [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate

[(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate (PubChem CID 172942335) has the molecular formula C156H242F7N21O78P12S and a molecular weight of 4196.46 g/mol. Its IUPAC name is [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate.

Molecular Properties

• Compound Name: [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate
• PubChem CID: 172942335
• Molecular Formula: C156H242F7N21O78P12S
• Molecular Weight: 4196.46 g/mol
• Exact Mass: 4194.21
• IUPAC Name: [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate
• SMILES: C/C(CCC(=O)CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.C/C(CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.C/C(CCCC(=O)CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.CC(C)(C)C(=O)ON1C(=O)CCC1=O.CC(C)(C)CC(=O)ON1C(=O)CCC1=O.Cc1c(F)c(F)c(F)c(OC(=O)C(C)(C)C)c1F.Cc1cc(F)c(F)c(OC(=O)C(C)(C)C)c1F.Cc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)CCCC(=O)CCCSC(C)(C)C)C(OP(=O)(O)O)C1O
• InChI: InChI=1S/C30H50N5O17P3.C29H48N5O17P3.C28H47N4O16P3S.C26H44N5O16P3.C12H12F4O2.C12H13F3O2.C10H15NO4.C9H13NO4/c1-18(34-51-29(3,4)5)10-8-11-20(36)12-9-13-21(37)26(39)30(6,7)15-48-55(45,46)52-54(43,44)47-14-22-25(50-53(40,41)42)24(38)28(49-22)35-17-33-23-19(2)31-16-32-27(23)35;1-17(33-50-28(3,4)5)11-12-19(35)9-8-10-20(36)25(38)29(6,7)14-47-54(44,45)51-53(42,43)46-13-21-24(49-52(39,40)41)23(37)27(48-21)34-16-32-22-18(2)30-15-31-26(22)34;1-17-21-25(30-15-29-17)32(16-31-21)26-22(35)23(47-49(37,38)39)20(46-26)13-44-50(40,41)48-51(42,43)45-14-28(5,6)24(36)19(34)11-7-9-18(33)10-8-12-52-27(2,3)4;1-15(30-46-25(3,4)5)9-8-10-17(32)22(34)26(6,7)12-43-50(40,41)47-49(38,39)42-11-18-21(45-48(35,36)37)20(33)24(44-18)31-14-29-19-16(2)27-13-28-23(19)31;1-5-6(13)8(15)9(16)10(7(5)14)18-11(17)12(2,3)4;1-6-5-7(13)9(15)10(8(6)14)17-11(16)12(2,3)4;1-10(2,3)6-9(14)15-11-7(12)4-5-8(11)13;1-9(2,3)8(13)14-10-6(11)4-5-7(10)12/h16-17,22,24-26,28,38-39H,8-15H2,1-7H3,(H,43,44)(H,45,46)(H2,40,41,42);15-16,21,23-25,27,37-38H,8-14H2,1-7H3,(H,42,43)(H,44,45)(H2,39,40,41);15-16,20,22-24,26,35-36H,7-14H2,1-6H3,(H,40,41)(H,42,43)(H2,37,38,39);13-14,18,20-22,24,33-34H,8-12H2,1-7H3,(H,38,39)(H,40,41)(H2,35,36,37);1-4H3;5H,1-4H3;4-6H2,1-3H3;4-5H2,1-3H3/b34-18+;33-17+;;30-15+
• InChIKey: VKACUGGWGZWZFM-ZSLBHWLUSA-N
• XLogP: 20.07
• TPSA: 1413.58 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 82
• Rotatable Bonds: 87
• Heavy Atoms: 275
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4196.46
LogP ≤ 5	20.07
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	82

Frequently Asked Questions

What is the IUPAC name of [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate?

The IUPAC name of [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate (CID 172942335) is [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate.

What is the SMILES notation for [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate?

The canonical SMILES for [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate is C/C(CCC(=O)CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.C/C(CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.C/C(CCCC(=O)CCCC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(C)ncnc32)C(O)C1OP(=O)(O)O)=N\OC(C)(C)C.CC(C)(C)C(=O)ON1C(=O)CCC1=O.CC(C)(C)CC(=O)ON1C(=O)CCC1=O.Cc1c(F)c(F)c(F)c(OC(=O)C(C)(C)C)c1F.Cc1cc(F)c(F)c(OC(=O)C(C)(C)C)c1F.Cc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)CCCC(=O)CCCSC(C)(C)C)C(OP(=O)(O)O)C1O.

What is the InChIKey of [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate?

The InChIKey is VKACUGGWGZWZFM-ZSLBHWLUSA-N. The full InChI is InChI=1S/C30H50N5O17P3.C29H48N5O17P3.C28H47N4O16P3S.C26H44N5O16P3.C12H12F4O2.C12H13F3O2.C10H15NO4.C9H13NO4/c1-18(34-51-29(3,4)5)10-8-11-20(36)12-9-13-21(37)26(39)30(6,7)15-48-55(45,46)52-54(43,44)47-14-22-25(50-53(40,41)42)24(38)28(49-22)35-17-33-23-19(2)31-16-32-27(23)35;1-17(33-50-28(3,4)5)11-12-19(35)9-8-10-20(36)25(38)29(6,7)14-47-54(44,45)51-53(42,43)46-13-21-24(49-52(39,40)41)23(37)27(48-21)34-16-32-22-18(2)30-15-31-26(22)34;1-17-21-25(30-15-29-17)32(16-31-21)26-22(35)23(47-49(37,38)39)20(46-26)13-44-50(40,41)48-51(42,43)45-14-28(5,6)24(36)19(34)11-7-9-18(33)10-8-12-52-27(2,3)4;1-15(30-46-25(3,4)5)9-8-10-17(32)22(34)26(6,7)12-43-50(40,41)47-49(38,39)42-11-18-21(45-48(35,36)37)20(33)24(44-18)31-14-29-19-16(2)27-13-28-23(19)31;1-5-6(13)8(15)9(16)10(7(5)14)18-11(17)12(2,3)4;1-6-5-7(13)9(15)10(8(6)14)17-11(16)12(2,3)4;1-10(2,3)6-9(14)15-11-7(12)4-5-8(11)13;1-9(2,3)8(13)14-10-6(11)4-5-7(10)12/h16-17,22,24-26,28,38-39H,8-15H2,1-7H3,(H,43,44)(H,45,46)(H2,40,41,42);15-16,21,23-25,27,37-38H,8-14H2,1-7H3,(H,42,43)(H,44,45)(H2,39,40,41);15-16,20,22-24,26,35-36H,7-14H2,1-6H3,(H,40,41)(H,42,43)(H2,37,38,39);13-14,18,20-22,24,33-34H,8-12H2,1-7H3,(H,38,39)(H,40,41)(H2,35,36,37);1-4H3;5H,1-4H3;4-6H2,1-3H3;4-5H2,1-3H3/b34-18+;33-17+;;30-15+;;;;.

What are the key properties of [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate?

[(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate has a molecular weight of 4196.46 g/mol, XLogP of 20.07, 87 rotatable bonds, 24 hydrogen bond donors, and 82 hydrogen bond acceptors.

Where does this data come from?

All data for [(11-tert-butylsulfanyl-3-hydroxy-2,2-dimethyl-4,8-dioxoundecoxy)-hydroxyphosphoryl] [4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate;(2,5-dioxopyrrolidin-1-yl) 3,3-dimethylbutanoate;(2,5-dioxopyrrolidin-1-yl) 2,2-dimethylpropanoate;[(11E)-3-hydroxy-2,2-dimethyl-11-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxododecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(12E)-3-hydroxy-2,2-dimethyl-12-[(2-methylpropan-2-yl)oxyimino]-4,8-dioxotridecyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;[(8E)-3-hydroxy-2,2-dimethyl-8-[(2-methylpropan-2-yl)oxyimino]-4-oxononyl] [hydroxy-[[4-hydroxy-5-(6-methylpurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate;(2,3,4,6-tetrafluoro-5-methylphenyl) 2,2-dimethylpropanoate;(2,3,6-trifluoro-5-methylphenyl) 2,2-dimethylpropanoate is sourced from PubChem (CID 172942335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).