4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid

C104H136F4N32O40P4S2 — CID 157400879

About 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid

4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid (PubChem CID 157400879) has the molecular formula C104H136F4N32O40P4S2 and a molecular weight of 2738.44 g/mol. Its IUPAC name is 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid.

Molecular Properties

• Compound Name: 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid
• PubChem CID: 157400879
• Molecular Formula: C104H136F4N32O40P4S2
• Molecular Weight: 2738.44 g/mol
• Exact Mass: 2736.79
• IUPAC Name: 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid
• SMILES: CC(CC(=O)NCCC(=O)N[C@H](C(=O)C[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)N(C)CCOC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](F)[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(O)(=S)O[C@H]3[C@H]2F)cc1)C(C)C)C(=O)O.CC(CC(=O)O)C(=O)NCCC(=O)N[C@H](C(=O)C[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)N(C)CCOC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](F)[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(=O)(S)O[C@H]3[C@H]2F)cc1)C(C)C
• InChI: InChI=1S/2C52H68F2N16O20P2S/c1-25(2)37(66-33(72)11-13-57-34(73)16-26(3)49(75)76)30(71)17-28(6-5-12-58-50(56)77)46(74)65-29-9-7-27(8-10-29)18-84-52(79)68(4)14-15-83-51(78)67-43-39-45(62-22-60-43)70(24-64-39)48-36(54)41-31(87-48)19-85-91(80,81)89-40-32(20-86-92(82,93)90-41)88-47(35(40)53)69-23-63-38-42(55)59-21-61-44(38)69;1-25(2)37(66-33(72)11-13-57-46(75)26(3)16-34(73)74)30(71)17-28(6-5-12-58-50(56)77)47(76)65-29-9-7-27(8-10-29)18-84-52(79)68(4)14-15-83-51(78)67-43-39-45(62-22-60-43)70(24-64-39)49-36(54)41-31(87-49)19-85-91(80,81)89-40-32(20-86-92(82,93)90-41)88-48(35(40)53)69-23-63-38-42(55)59-21-61-44(38)69/h7-10,21-26,28,31-32,35-37,40-41,47-48H,5-6,11-20H2,1-4H3,(H,57,73)(H,65,74)(H,66,72)(H,75,76)(H,80,81)(H,82,93)(H2,55,59,61)(H3,56,58,77)(H,60,62,67,78);7-10,21-26,28,31-32,35-37,40-41,48-49H,5-6,11-20H2,1-4H3,(H,57,75)(H,65,76)(H,66,72)(H,73,74)(H,80,81)(H,82,93)(H2,55,59,61)(H3,56,58,77)(H,60,62,67,78)/t26?,28-,31-,32-,35-,36-,37+,40-,41-,47-,48-,92?;26?,28-,31-,32-,35-,36-,37+,40-,41-,48-,49-,92?/m11/s1
• InChIKey: BNDJUUQTFVKGLM-BTAZGZCWSA-N
• XLogP: 5.60
• TPSA: 978.42 Ų
• H-Bond Donors: 20
• H-Bond Acceptors: 54
• Rotatable Bonds: 50
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2738.44
LogP ≤ 5	5.60
H-Bond Donors ≤ 5	20
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid?

The IUPAC name of 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid (CID 157400879) is 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid.

What is the SMILES notation for 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid?

The canonical SMILES for 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid is CC(CC(=O)NCCC(=O)N[C@H](C(=O)C[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)N(C)CCOC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](F)[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(O)(=S)O[C@H]3[C@H]2F)cc1)C(C)C)C(=O)O.CC(CC(=O)O)C(=O)NCCC(=O)N[C@H](C(=O)C[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)N(C)CCOC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](F)[C@H](n5cnc6c(N)ncnc65)O[C@@H]4COP(=O)(S)O[C@H]3[C@H]2F)cc1)C(C)C.

What is the InChIKey of 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid?

The InChIKey is BNDJUUQTFVKGLM-BTAZGZCWSA-N. The full InChI is InChI=1S/2C52H68F2N16O20P2S/c1-25(2)37(66-33(72)11-13-57-34(73)16-26(3)49(75)76)30(71)17-28(6-5-12-58-50(56)77)46(74)65-29-9-7-27(8-10-29)18-84-52(79)68(4)14-15-83-51(78)67-43-39-45(62-22-60-43)70(24-64-39)48-36(54)41-31(87-48)19-85-91(80,81)89-40-32(20-86-92(82,93)90-41)88-47(35(40)53)69-23-63-38-42(55)59-21-61-44(38)69;1-25(2)37(66-33(72)11-13-57-46(75)26(3)16-34(73)74)30(71)17-28(6-5-12-58-50(56)77)47(76)65-29-9-7-27(8-10-29)18-84-52(79)68(4)14-15-83-51(78)67-43-39-45(62-22-60-43)70(24-64-39)49-36(54)41-31(87-49)19-85-91(80,81)89-40-32(20-86-92(82,93)90-41)88-48(35(40)53)69-23-63-38-42(55)59-21-61-44(38)69/h7-10,21-26,28,31-32,35-37,40-41,47-48H,5-6,11-20H2,1-4H3,(H,57,73)(H,65,74)(H,66,72)(H,75,76)(H,80,81)(H,82,93)(H2,55,59,61)(H3,56,58,77)(H,60,62,67,78);7-10,21-26,28,31-32,35-37,40-41,48-49H,5-6,11-20H2,1-4H3,(H,57,75)(H,65,76)(H,66,72)(H,73,74)(H,80,81)(H,82,93)(H2,55,59,61)(H3,56,58,77)(H,60,62,67,78)/t26?,28-,31-,32-,35-,36-,37+,40-,41-,47-,48-,92?;26?,28-,31-,32-,35-,36-,37+,40-,41-,48-,49-,92?/m11/s1.

What are the key properties of 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid?

4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid has a molecular weight of 2738.44 g/mol, XLogP of 5.60, 50 rotatable bonds, 20 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3-oxo-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-2-methyl-4-oxobutanoic acid;4-[[3-[[(3S,6R)-6-[[4-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3-hydroxy-3,12-dioxo-12-sulfanyl-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]purin-6-yl]carbamoyloxy]ethyl-methylcarbamoyl]oxymethyl]phenyl]carbamoyl]-9-(carbamoylamino)-2-methyl-4-oxononan-3-yl]amino]-3-oxopropyl]amino]-3-methyl-4-oxobutanoic acid is sourced from PubChem (CID 157400879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).