[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate

C121H181F4N27O90P12 — CID 157114112

IUPAC[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate
SMILESCC(=O)OCC1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@@H](OC(C)=O)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2F)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@H](F)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(O)[C@@H](C)[C@@H]1C.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@@H](F)CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@H](O)CO)[C@@H](O)[C@H](O)C2O)C(F)[C@@H]1O
InChIInChI=1S/C25H36FN5O16P2.C22H33N5O15P2.C21H32FN5O14P2.2C18H27FN4O15P2.C17H26N4O15P2/c1-10-11(2)21(43-14(5)34)25(45-20(10)16(42-13(4)33)6-40-12(3)32)46-49(38,39)47-48(36,37)41-7-15-17(26)19(35)24(44-15)31-9-30-18-22(27)28-8-29-23(18)31;1-9-10(2)18(38-12(4)29)22(40-13(9)5-36-11(3)28)41-44(34,35)42-43(32,33)37-6-14-16(30)17(31)21(39-14)27-8-26-15-19(23)24-7-25-20(15)27;1-8-9(2)17(11(22)4-36-10(3)28)39-21(14(8)29)40-43(34,35)41-42(32,33)37-5-12-15(30)16(31)20(38-12)27-7-26-13-18(23)24-6-25-19(13)27;19-6(3-24)15-12(27)11(26)14(29)18(36-15)37-40(32,33)38-39(30,31)34-4-8-10(25)13(28)17(35-8)23-5-22-9-7(20)1-2-21-16(9)23;19-9-8(35-17(11(9)26)23-5-22-10-6(20)1-2-21-16(10)23)4-34-39(30,31)38-40(32,33)37-18-14(29)12(27)13(28)15(36-18)7(25)3-24;18-6-1-2-19-15-9(6)20-5-21(15)16-13(26)11(24)8(33-16)4-32-37(28,29)36-38(30,31)35-17-14(27)12(25)10(23)7(3-22)34-17/h8-11,15-17,19-21,24-25,35H,6-7H2,1-5H3,(H,36,37)(H,38,39)(H2,27,28,29);7-10,13-14,16-18,21-22,30-31H,5-6H2,1-4H3,(H,32,33)(H,34,35)(H2,23,24,25);6-9,11-12,14-17,20-21,29-31H,4-5H2,1-3H3,(H,32,33)(H,34,35)(H2,23,24,25);1-2,5-6,8,10-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-9,11-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-8,10-14,16-17,22-27H,3-4H2,(H2,18,19)(H,28,29)(H,30,31)/t10-,11-,15+,16+,17?,19-,20?,21?,24+,25-;9-,10-,13?,14+,16?,17-,18?,21+,22-;8-,9-,11-,12+,14?,15?,16-,17?,20+,21-;6-,8+,10?,11-,12-,13-,14?,15?,17+,18-;7-,8-,9?,11+,12+,13+,14?,15?,17-,18+;7?,8-,10-,11?,12+,13+,14?,16-,17+/m000011/s1
InChIKeyAHEOSBOBVYWJSQ-OWDWFORBSA-N
MW3901.56 g/mol
LogP-9.29
Rot. Bonds64

About [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate

[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate (PubChem CID 157114112) has the molecular formula C121H181F4N27O90P12 and a molecular weight of 3901.56 g/mol. Its IUPAC name is [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate.

Molecular Properties

Compound Name[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate
PubChem CID157114112
Molecular FormulaC121H181F4N27O90P12
Molecular Weight3901.56 g/mol
Exact Mass3899.72
IUPAC Name[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate
SMILESCC(=O)OCC1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@@H](OC(C)=O)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2F)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@H](F)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(O)[C@@H](C)[C@@H]1C.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@@H](F)CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@H](O)CO)[C@@H](O)[C@H](O)C2O)C(F)[C@@H]1O
InChIInChI=1S/C25H36FN5O16P2.C22H33N5O15P2.C21H32FN5O14P2.2C18H27FN4O15P2.C17H26N4O15P2/c1-10-11(2)21(43-14(5)34)25(45-20(10)16(42-13(4)33)6-40-12(3)32)46-49(38,39)47-48(36,37)41-7-15-17(26)19(35)24(44-15)31-9-30-18-22(27)28-8-29-23(18)31;1-9-10(2)18(38-12(4)29)22(40-13(9)5-36-11(3)28)41-44(34,35)42-43(32,33)37-6-14-16(30)17(31)21(39-14)27-8-26-15-19(23)24-7-25-20(15)27;1-8-9(2)17(11(22)4-36-10(3)28)39-21(14(8)29)40-43(34,35)41-42(32,33)37-5-12-15(30)16(31)20(38-12)27-7-26-13-18(23)24-6-25-19(13)27;19-6(3-24)15-12(27)11(26)14(29)18(36-15)37-40(32,33)38-39(30,31)34-4-8-10(25)13(28)17(35-8)23-5-22-9-7(20)1-2-21-16(9)23;19-9-8(35-17(11(9)26)23-5-22-10-6(20)1-2-21-16(10)23)4-34-39(30,31)38-40(32,33)37-18-14(29)12(27)13(28)15(36-18)7(25)3-24;18-6-1-2-19-15-9(6)20-5-21(15)16-13(26)11(24)8(33-16)4-32-37(28,29)36-38(30,31)35-17-14(27)12(25)10(23)7(3-22)34-17/h8-11,15-17,19-21,24-25,35H,6-7H2,1-5H3,(H,36,37)(H,38,39)(H2,27,28,29);7-10,13-14,16-18,21-22,30-31H,5-6H2,1-4H3,(H,32,33)(H,34,35)(H2,23,24,25);6-9,11-12,14-17,20-21,29-31H,4-5H2,1-3H3,(H,32,33)(H,34,35)(H2,23,24,25);1-2,5-6,8,10-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-9,11-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-8,10-14,16-17,22-27H,3-4H2,(H2,18,19)(H,28,29)(H,30,31)/t10-,11-,15+,16+,17?,19-,20?,21?,24+,25-;9-,10-,13?,14+,16?,17-,18?,21+,22-;8-,9-,11-,12+,14?,15?,16-,17?,20+,21-;6-,8+,10?,11-,12-,13-,14?,15?,17+,18-;7-,8-,9?,11+,12+,13+,14?,15?,17-,18+;7?,8-,10-,11?,12+,13+,14?,16-,17+/m000011/s1
InChIKeyAHEOSBOBVYWJSQ-OWDWFORBSA-N
XLogP-9.29
TPSA1746.87 Ų
H-Bond Donors42
H-Bond Acceptors105
Rotatable Bonds64
Heavy Atoms254
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003901.56
LogP ≤ 5-9.29
H-Bond Donors ≤ 542
H-Bond Acceptors ≤ 10105

Analyze [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate with MolForge

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What is the IUPAC name of [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate?
The IUPAC name of [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate (CID 157114112) is [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate.
What is the SMILES notation for [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate?
The canonical SMILES for [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate is CC(=O)OCC1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@@H](OC(C)=O)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2F)C(OC(C)=O)[C@@H](C)[C@@H]1C.CC(=O)OC[C@H](F)C1O[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)C2O)C(O)[C@@H](C)[C@@H]1C.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@@H](F)CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H]1O.Nc1ccnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]2OC([C@H](O)CO)[C@@H](O)[C@H](O)C2O)C(F)[C@@H]1O.
What is the InChIKey of [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate?
The InChIKey is AHEOSBOBVYWJSQ-OWDWFORBSA-N. The full InChI is InChI=1S/C25H36FN5O16P2.C22H33N5O15P2.C21H32FN5O14P2.2C18H27FN4O15P2.C17H26N4O15P2/c1-10-11(2)21(43-14(5)34)25(45-20(10)16(42-13(4)33)6-40-12(3)32)46-49(38,39)47-48(36,37)41-7-15-17(26)19(35)24(44-15)31-9-30-18-22(27)28-8-29-23(18)31;1-9-10(2)18(38-12(4)29)22(40-13(9)5-36-11(3)28)41-44(34,35)42-43(32,33)37-6-14-16(30)17(31)21(39-14)27-8-26-15-19(23)24-7-25-20(15)27;1-8-9(2)17(11(22)4-36-10(3)28)39-21(14(8)29)40-43(34,35)41-42(32,33)37-5-12-15(30)16(31)20(38-12)27-7-26-13-18(23)24-6-25-19(13)27;19-6(3-24)15-12(27)11(26)14(29)18(36-15)37-40(32,33)38-39(30,31)34-4-8-10(25)13(28)17(35-8)23-5-22-9-7(20)1-2-21-16(9)23;19-9-8(35-17(11(9)26)23-5-22-10-6(20)1-2-21-16(10)23)4-34-39(30,31)38-40(32,33)37-18-14(29)12(27)13(28)15(36-18)7(25)3-24;18-6-1-2-19-15-9(6)20-5-21(15)16-13(26)11(24)8(33-16)4-32-37(28,29)36-38(30,31)35-17-14(27)12(25)10(23)7(3-22)34-17/h8-11,15-17,19-21,24-25,35H,6-7H2,1-5H3,(H,36,37)(H,38,39)(H2,27,28,29);7-10,13-14,16-18,21-22,30-31H,5-6H2,1-4H3,(H,32,33)(H,34,35)(H2,23,24,25);6-9,11-12,14-17,20-21,29-31H,4-5H2,1-3H3,(H,32,33)(H,34,35)(H2,23,24,25);1-2,5-6,8,10-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-9,11-15,17-18,24-29H,3-4H2,(H2,20,21)(H,30,31)(H,32,33);1-2,5,7-8,10-14,16-17,22-27H,3-4H2,(H2,18,19)(H,28,29)(H,30,31)/t10-,11-,15+,16+,17?,19-,20?,21?,24+,25-;9-,10-,13?,14+,16?,17-,18?,21+,22-;8-,9-,11-,12+,14?,15?,16-,17?,20+,21-;6-,8+,10?,11-,12-,13-,14?,15?,17+,18-;7-,8-,9?,11+,12+,13+,14?,15?,17-,18+;7?,8-,10-,11?,12+,13+,14?,16-,17+/m000011/s1.
What are the key properties of [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate?
[(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate has a molecular weight of 3901.56 g/mol, XLogP of -9.29, 64 rotatable bonds, 42 hydrogen bond donors, and 105 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-acetyloxy-2-[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4R,5R)-5-(6-aminopurin-9-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]ethyl] acetate;[(3S,4S,6S)-5-acetyloxy-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4-dimethyloxan-2-yl]methyl acetate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1S)-1-fluoro-2-hydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[[(2R,4S,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate;[[(2R,4R,5R)-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,4S,5S)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl] hydrogen phosphate;[(2S)-2-[(3S,4S,6S)-6-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-3,4-dimethyloxan-2-yl]-2-fluoroethyl] acetate is sourced from PubChem (CID 157114112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).