1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione

C84H105N22O41P7S7 — CID 160906964

About 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione

1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione (PubChem CID 160906964) has the molecular formula C84H105N22O41P7S7 and a molecular weight of 2520.16 g/mol. Its IUPAC name is 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione.

Molecular Properties

• Compound Name: 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione
• PubChem CID: 160906964
• Molecular Formula: C84H105N22O41P7S7
• Molecular Weight: 2520.16 g/mol
• Exact Mass: 2518.30
• IUPAC Name: 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione
• SMILES: CC1=CN([C@@H]2O[C@@]3(COP(O)(=S)O[C@H]4C[C@H](n5ccc(N)cc5=O)OC4OP(O)(=S)O[C@H]4C[C@H](n5ccc(N)cc5=O)O[C@@H]4COP(O)(=S)O[C@H]4C[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(=O)(S)O[C@H]4C[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(O)(=S)O[C@H]4C[C@H](N5C=C(C)C(=O)CC5=O)O[C@@H]4C)COC2[C@@H]3OP(O)(=S)OC[C@@]23COC([C@H](n4cc(C)c(N)nc4=O)O2)[C@@H]3OP(O)(=S)OC[C@@]23COC([C@H](n4cc(C)c(N)nc4=O)O2)[C@@H]3O)C(=O)CC1=O
• InChI: InChI=1S/C84H105N22O41P7S7/c1-36-19-101(55(111)12-43(36)107)59-14-45(40(5)132-59)140-148(116,155)126-23-50-46(16-60(134-50)105-34-95-62-72(89)91-32-93-74(62)105)141-149(117,156)127-24-51-47(17-61(135-51)106-35-96-63-73(90)92-33-94-75(63)106)142-150(118,157)128-25-52-48(15-57(133-52)99-8-6-41(85)10-53(99)109)143-154(122,161)147-79-49(18-58(136-79)100-9-7-42(86)11-54(100)110)144-151(119,158)130-30-83-27-124-65(77(138-83)102-20-37(2)44(108)13-56(102)112)68(83)145-153(121,160)131-31-84-28-125-66(78(139-84)104-22-39(4)71(88)98-81(104)115)69(84)146-152(120,159)129-29-82-26-123-64(67(82)113)76(137-82)103-21-38(3)70(87)97-80(103)114/h6-11,19-22,32-35,40,45-52,57-61,64-69,76-79,113H,12-18,23-31,85-86H2,1-5H3,(H,116,155)(H,117,156)(H,118,157)(H,119,158)(H,120,159)(H,121,160)(H,122,161)(H2,87,97,114)(H2,88,98,115)(H2,89,91,93)(H2,90,92,94)/t40-,45+,46+,47+,48+,49+,50-,51-,52-,57-,58-,59-,60-,61-,64?,65?,66?,67+,68+,69+,76-,77-,78-,79?,82-,83-,84-,148?,149?,150?,151?,152?,153?,154?/m1/s1
• InChIKey: SQGRZJGUFPVVAC-SLMGGMSSSA-N
• XLogP: 1.01
• TPSA: 821.29 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 61
• Rotatable Bonds: 42
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2520.16
LogP ≤ 5	1.01
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	61

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione?

The IUPAC name of 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione (CID 160906964) is 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione.

What is the SMILES notation for 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione?

The canonical SMILES for 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione is CC1=CN([C@@H]2O[C@@]3(COP(O)(=S)O[C@H]4C[C@H](n5ccc(N)cc5=O)OC4OP(O)(=S)O[C@H]4C[C@H](n5ccc(N)cc5=O)O[C@@H]4COP(O)(=S)O[C@H]4C[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(=O)(S)O[C@H]4C[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(O)(=S)O[C@H]4C[C@H](N5C=C(C)C(=O)CC5=O)O[C@@H]4C)COC2[C@@H]3OP(O)(=S)OC[C@@]23COC([C@H](n4cc(C)c(N)nc4=O)O2)[C@@H]3OP(O)(=S)OC[C@@]23COC([C@H](n4cc(C)c(N)nc4=O)O2)[C@@H]3O)C(=O)CC1=O.

What is the InChIKey of 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione?

The InChIKey is SQGRZJGUFPVVAC-SLMGGMSSSA-N. The full InChI is InChI=1S/C84H105N22O41P7S7/c1-36-19-101(55(111)12-43(36)107)59-14-45(40(5)132-59)140-148(116,155)126-23-50-46(16-60(134-50)105-34-95-62-72(89)91-32-93-74(62)105)141-149(117,156)127-24-51-47(17-61(135-51)106-35-96-63-73(90)92-33-94-75(63)106)142-150(118,157)128-25-52-48(15-57(133-52)99-8-6-41(85)10-53(99)109)143-154(122,161)147-79-49(18-58(136-79)100-9-7-42(86)11-54(100)110)144-151(119,158)130-30-83-27-124-65(77(138-83)102-20-37(2)44(108)13-56(102)112)68(83)145-153(121,160)131-31-84-28-125-66(78(139-84)104-22-39(4)71(88)98-81(104)115)69(84)146-152(120,159)129-29-82-26-123-64(67(82)113)76(137-82)103-21-38(3)70(87)97-80(103)114/h6-11,19-22,32-35,40,45-52,57-61,64-69,76-79,113H,12-18,23-31,85-86H2,1-5H3,(H,116,155)(H,117,156)(H,118,157)(H,119,158)(H,120,159)(H,121,160)(H,122,161)(H2,87,97,114)(H2,88,98,115)(H2,89,91,93)(H2,90,92,94)/t40-,45+,46+,47+,48+,49+,50-,51-,52-,57-,58-,59-,60-,61-,64?,65?,66?,67+,68+,69+,76-,77-,78-,79?,82-,83-,84-,148?,149?,150?,151?,152?,153?,154?/m1/s1.

What are the key properties of 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione?

1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione has a molecular weight of 2520.16 g/mol, XLogP of 1.01, 42 rotatable bonds, 14 hydrogen bond donors, and 61 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2R,4S,5R)-4-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(3S,5R)-3-[[(1R,3R,7S)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-[[(1R,3R,7S)-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(5-methyl-2,4-dioxo-1-pyridinyl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]oxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxo-1-pyridinyl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-methyloxolan-2-yl]-5-methylpyridine-2,4-dione is sourced from PubChem (CID 160906964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).