[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid

C150H267F5N25O25P5Si4 — CID 167572801

IUPAC[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid
SMILESCC(C)C[Si](C)(C)C#CCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.CC(C)C[Si](C)(C)CCCCCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCC#C[Si](C)(C)C1CC2CCC1C2.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCCCCCC(F)(F)C(F)(F)F.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCC[Si](C)(C)C1CC2CCC1C2
InChIInChI=1S/C32H58N5O5PSi.C32H54N5O5PSi.C30H58N5O5PSi.C28H47F5N5O5P.C28H50N5O5PSi/c2*1-26(22-37-24-36-30-31(33)34-23-35-32(30)37)41-25-43(38,39)42-18-13-17-40-16-11-9-7-5-4-6-8-10-12-19-44(2,3)29-21-27-14-15-28(29)20-27;1-26(2)22-42(4,5)20-15-13-11-9-7-6-8-10-12-14-17-38-18-16-19-40-41(36,37)25-39-27(3)21-35-24-34-28-29(31)32-23-33-30(28)35;1-23(19-38-21-37-24-25(34)35-20-36-26(24)38)42-22-44(39,40)43-18-14-17-41-16-13-11-9-7-5-3-2-4-6-8-10-12-15-27(29,30)28(31,32)33;1-24(2)20-40(4,5)18-13-11-9-7-6-8-10-12-15-36-16-14-17-38-39(34,35)23-37-25(3)19-33-22-32-26-27(29)30-21-31-28(26)33/h23-24,26-29H,4-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-29H,4-11,13-18,20-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-27H,6-22,25H2,1-5H3,(H,36,37)(H2,31,32,33);20-21,23H,2-19,22H2,1H3,(H,39,40)(H2,34,35,36);21-22,24-25H,6-12,14-17,19-20,23H2,1-5H3,(H,34,35)(H2,29,30,31)/t2*26-,27?,28?,29?;27-;23-;25-/m11111/s1
InChIKeyGDELGIRUJNHEKH-XWZDJZEHSA-N
MW3183.14 g/mol
LogP36.04
Rot. Bonds113

About [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid

[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid (PubChem CID 167572801) has the molecular formula C150H267F5N25O25P5Si4 and a molecular weight of 3183.14 g/mol. Its IUPAC name is [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid.

Molecular Properties

Compound Name[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid
PubChem CID167572801
Molecular FormulaC150H267F5N25O25P5Si4
Molecular Weight3183.14 g/mol
Exact Mass3180.81
IUPAC Name[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid
SMILESCC(C)C[Si](C)(C)C#CCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.CC(C)C[Si](C)(C)CCCCCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCC#C[Si](C)(C)C1CC2CCC1C2.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCCCCCC(F)(F)C(F)(F)F.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCC[Si](C)(C)C1CC2CCC1C2
InChIInChI=1S/C32H58N5O5PSi.C32H54N5O5PSi.C30H58N5O5PSi.C28H47F5N5O5P.C28H50N5O5PSi/c2*1-26(22-37-24-36-30-31(33)34-23-35-32(30)37)41-25-43(38,39)42-18-13-17-40-16-11-9-7-5-4-6-8-10-12-19-44(2,3)29-21-27-14-15-28(29)20-27;1-26(2)22-42(4,5)20-15-13-11-9-7-6-8-10-12-14-17-38-18-16-19-40-41(36,37)25-39-27(3)21-35-24-34-28-29(31)32-23-33-30(28)35;1-23(19-38-21-37-24-25(34)35-20-36-26(24)38)42-22-44(39,40)43-18-14-17-41-16-13-11-9-7-5-3-2-4-6-8-10-12-15-27(29,30)28(31,32)33;1-24(2)20-40(4,5)18-13-11-9-7-6-8-10-12-15-36-16-14-17-38-39(34,35)23-37-25(3)19-33-22-32-26-27(29)30-21-31-28(26)33/h23-24,26-29H,4-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-29H,4-11,13-18,20-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-27H,6-22,25H2,1-5H3,(H,36,37)(H2,31,32,33);20-21,23H,2-19,22H2,1H3,(H,39,40)(H2,34,35,36);21-22,24-25H,6-12,14-17,19-20,23H2,1-5H3,(H,34,35)(H2,29,30,31)/t2*26-,27?,28?,29?;27-;23-;25-/m11111/s1
InChIKeyGDELGIRUJNHEKH-XWZDJZEHSA-N
XLogP36.04
TPSA673.05 Ų
H-Bond Donors10
H-Bond Acceptors45
Rotatable Bonds113
Heavy Atoms214
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003183.14
LogP ≤ 536.04
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid with MolForge

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Related Compounds

[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[2-[12-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]dodecoxy]ethoxy]phosphinic acid
CID 156642449
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid
CID 165160397
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(3,3,3-trifluoropropyl)silyl]dodecoxy]propoxy]phosphinic acid
CID 156642438
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[15-[cyclohexyl(dimethyl)silyl]pentadec-14-ynoxy]phosphinic acid
CID 165160389
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(16,16,16-trifluorohexadecoxy)propoxy]phosphinic acid;azane
CID 166636153
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(18-trimethylsilyloctadec-17-ynoxy)phosphinic acid;azane
CID 166627399
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[15-(trimethyl-λ4-sulfanyl)pentadec-14-ynoxy]propoxy]phosphinic acid
CID 167219507
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[4-(trifluoromethyl)phenyl]undec-10-ynoxy]propoxy]phosphinic acid
CID 156642314
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecylsulfanyl]propoxy]phosphinic acid
CID 156642572
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[2-(15-cyclopropylpentadecoxy)ethoxy]phosphinic acid
CID 156642405
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(18-trimethylsilyloctadecoxy)phosphinic acid;azane
CID 175774143
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[2-[12-[2-bicyclo[2.2.1]heptanyl(dimethyl)-λ4-sulfanyl]dodec-11-ynylsulfanyl]ethoxy]phosphinic acid
CID 167219530

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid?
The IUPAC name of [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid (CID 167572801) is [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid.
What is the SMILES notation for [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid?
The canonical SMILES for [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid is CC(C)C[Si](C)(C)C#CCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.CC(C)C[Si](C)(C)CCCCCCCCCCCCOCCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCC#C[Si](C)(C)C1CC2CCC1C2.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCCCCCC(F)(F)C(F)(F)F.C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)OCCCOCCCCCCCCCCC[Si](C)(C)C1CC2CCC1C2.
What is the InChIKey of [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid?
The InChIKey is GDELGIRUJNHEKH-XWZDJZEHSA-N. The full InChI is InChI=1S/C32H58N5O5PSi.C32H54N5O5PSi.C30H58N5O5PSi.C28H47F5N5O5P.C28H50N5O5PSi/c2*1-26(22-37-24-36-30-31(33)34-23-35-32(30)37)41-25-43(38,39)42-18-13-17-40-16-11-9-7-5-4-6-8-10-12-19-44(2,3)29-21-27-14-15-28(29)20-27;1-26(2)22-42(4,5)20-15-13-11-9-7-6-8-10-12-14-17-38-18-16-19-40-41(36,37)25-39-27(3)21-35-24-34-28-29(31)32-23-33-30(28)35;1-23(19-38-21-37-24-25(34)35-20-36-26(24)38)42-22-44(39,40)43-18-14-17-41-16-13-11-9-7-5-3-2-4-6-8-10-12-15-27(29,30)28(31,32)33;1-24(2)20-40(4,5)18-13-11-9-7-6-8-10-12-15-36-16-14-17-38-39(34,35)23-37-25(3)19-33-22-32-26-27(29)30-21-31-28(26)33/h23-24,26-29H,4-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-29H,4-11,13-18,20-22,25H2,1-3H3,(H,38,39)(H2,33,34,35);23-24,26-27H,6-22,25H2,1-5H3,(H,36,37)(H2,31,32,33);20-21,23H,2-19,22H2,1H3,(H,39,40)(H2,34,35,36);21-22,24-25H,6-12,14-17,19-20,23H2,1-5H3,(H,34,35)(H2,29,30,31)/t2*26-,27?,28?,29?;27-;23-;25-/m11111/s1.
What are the key properties of [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid?
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid has a molecular weight of 3183.14 g/mol, XLogP of 36.04, 113 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[11-[2-bicyclo[2.2.1]heptanyl(dimethyl)silyl]undec-10-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[10-[dimethyl(2-methylpropyl)silyl]dec-9-ynoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-[12-[dimethyl(2-methylpropyl)silyl]dodecoxy]propoxy]phosphinic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(15,15,16,16,16-pentafluorohexadecoxy)propoxy]phosphinic acid is sourced from PubChem (CID 167572801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).