ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate

C125H195N27O38P4 — CID 159709736

About ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate

ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate (PubChem CID 159709736) has the molecular formula C125H195N27O38P4 and a molecular weight of 2807.98 g/mol. Its IUPAC name is ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate.

Molecular Properties

• Compound Name: ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate
• PubChem CID: 159709736
• Molecular Formula: C125H195N27O38P4
• Molecular Weight: 2807.98 g/mol
• Exact Mass: 2806.31
• IUPAC Name: ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate
• SMILES: CCCOc1nc(C)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(N[C@@H](CC(C)C)C(=O)OCC)N[C@@H](CC(C)C)C(=O)OCC)C(O)[C@]1(C)O.CCOC(=O)[C@H](C)NP(=O)(N[C@@H](C)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(NC4CC4)nc(C)nc32)[C@@](C)(O)C1O.CCOC(=O)[C@H](CC(C)C)NP(=O)(N[C@@H](CC(C)C)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(N4CCOCC4)nc(C)nc32)[C@@](C)(O)C1O.CCOC(=O)[C@H](Cc1ccccc1)NP(=O)(N[C@@H](Cc1ccccc1)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(NC4CC4)nc(C)nc32)[C@@](C)(O)C1O
• InChI: InChI=1S/C37H48N7O9P.C32H54N7O10P.C31H53N6O10P.C25H40N7O9P/c1-5-50-34(46)27(19-24-13-9-7-10-14-24)42-54(49,43-28(35(47)51-6-2)20-25-15-11-8-12-16-25)52-21-29-31(45)37(4,48)36(53-29)44-22-38-30-32(41-26-17-18-26)39-23(3)40-33(30)44;1-9-46-29(41)22(15-19(3)4)36-50(44,37-23(16-20(5)6)30(42)47-10-2)48-17-24-26(40)32(8,43)31(49-24)39-18-33-25-27(34-21(7)35-28(25)39)38-11-13-45-14-12-38;1-10-13-45-27-24-26(33-20(8)34-27)37(17-32-24)30-31(9,41)25(38)23(47-30)16-46-48(42,35-21(14-18(4)5)28(39)43-11-2)36-22(15-19(6)7)29(40)44-12-3;1-7-38-22(34)13(3)30-42(37,31-14(4)23(35)39-8-2)40-11-17-19(33)25(6,36)24(41-17)32-12-26-18-20(29-16-9-10-16)27-15(5)28-21(18)32/h7-16,22,26-29,31,36,45,48H,5-6,17-21H2,1-4H3,(H,39,40,41)(H2,42,43,49);18-20,22-24,26,31,40,43H,9-17H2,1-8H3,(H2,36,37,44);17-19,21-23,25,30,38,41H,10-16H2,1-9H3,(H2,35,36,42);12-14,16-17,19,24,33,36H,7-11H2,1-6H3,(H,27,28,29)(H2,30,31,37)/t27-,28-,29+,31?,36+,37-;22-,23-,24+,26?,31+,32-;21-,22-,23+,25?,30+,31-;13-,14-,17+,19?,24+,25-/m0000/s1
• InChIKey: MYRGGQYPCHVZMI-KYFCXKPKSA-N
• XLogP: 9.73
• TPSA: 830.76 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 57
• Rotatable Bonds: 68
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2807.98
LogP ≤ 5	9.73
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	57

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate?

The IUPAC name of ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate (CID 159709736) is ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate.

What is the SMILES notation for ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate?

The canonical SMILES for ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate is CCCOc1nc(C)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(N[C@@H](CC(C)C)C(=O)OCC)N[C@@H](CC(C)C)C(=O)OCC)C(O)[C@]1(C)O.CCOC(=O)[C@H](C)NP(=O)(N[C@@H](C)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(NC4CC4)nc(C)nc32)[C@@](C)(O)C1O.CCOC(=O)[C@H](CC(C)C)NP(=O)(N[C@@H](CC(C)C)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(N4CCOCC4)nc(C)nc32)[C@@](C)(O)C1O.CCOC(=O)[C@H](Cc1ccccc1)NP(=O)(N[C@@H](Cc1ccccc1)C(=O)OCC)OC[C@H]1O[C@@H](n2cnc3c(NC4CC4)nc(C)nc32)[C@@](C)(O)C1O.

What is the InChIKey of ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate?

The InChIKey is MYRGGQYPCHVZMI-KYFCXKPKSA-N. The full InChI is InChI=1S/C37H48N7O9P.C32H54N7O10P.C31H53N6O10P.C25H40N7O9P/c1-5-50-34(46)27(19-24-13-9-7-10-14-24)42-54(49,43-28(35(47)51-6-2)20-25-15-11-8-12-16-25)52-21-29-31(45)37(4,48)36(53-29)44-22-38-30-32(41-26-17-18-26)39-23(3)40-33(30)44;1-9-46-29(41)22(15-19(3)4)36-50(44,37-23(16-20(5)6)30(42)47-10-2)48-17-24-26(40)32(8,43)31(49-24)39-18-33-25-27(34-21(7)35-28(25)39)38-11-13-45-14-12-38;1-10-13-45-27-24-26(33-20(8)34-27)37(17-32-24)30-31(9,41)25(38)23(47-30)16-46-48(42,35-21(14-18(4)5)28(39)43-11-2)36-22(15-19(6)7)29(40)44-12-3;1-7-38-22(34)13(3)30-42(37,31-14(4)23(35)39-8-2)40-11-17-19(33)25(6,36)24(41-17)32-12-26-18-20(29-16-9-10-16)27-15(5)28-21(18)32/h7-16,22,26-29,31,36,45,48H,5-6,17-21H2,1-4H3,(H,39,40,41)(H2,42,43,49);18-20,22-24,26,31,40,43H,9-17H2,1-8H3,(H2,36,37,44);17-19,21-23,25,30,38,41H,10-16H2,1-9H3,(H2,35,36,42);12-14,16-17,19,24,33,36H,7-11H2,1-6H3,(H,27,28,29)(H2,30,31,37)/t27-,28-,29+,31?,36+,37-;22-,23-,24+,26?,31+,32-;21-,22-,23+,25?,30+,31-;13-,14-,17+,19?,24+,25-/m0000/s1.

What are the key properties of ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate?

ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate has a molecular weight of 2807.98 g/mol, XLogP of 9.73, 68 rotatable bonds, 18 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]amino]phosphoryl]amino]-3-phenylpropanoate;ethyl (2S)-2-[[[(2R,4S,5R)-5-[6-(cyclopropylamino)-2-methylpurin-9-yl]-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]phosphoryl]amino]propanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-morpholin-4-ylpurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate;ethyl (2S)-2-[[[(2R,4S,5R)-3,4-dihydroxy-4-methyl-5-(2-methyl-6-propoxypurin-9-yl)oxolan-2-yl]methoxy-[[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]amino]phosphoryl]amino]-4-methylpentanoate is sourced from PubChem (CID 159709736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).