N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide

C149H212N67O53P13S13 — CID 162016351

About N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide

N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide (PubChem CID 162016351) has the molecular formula C149H212N67O53P13S13 and a molecular weight of 4609.28 g/mol. Its IUPAC name is N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide.

Molecular Properties

• Compound Name: N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide
• PubChem CID: 162016351
• Molecular Formula: C149H212N67O53P13S13
• Molecular Weight: 4609.28 g/mol
• Exact Mass: 4605.89
• IUPAC Name: N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide
• SMILES: CCCCCCCCCCCCCCCC(=O)NCC(O)COP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ccnc32)C[C@H]1N
• InChI: InChI=1S/C149H212N67O53P13S13/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-99(218)162-36-70(217)40-255-282(242,295)256-53-97-76(27-104(261-97)207-39-69(4)137(221)191-149(207)229)195-274(234,287)249-47-91-80(31-108(264-91)212-62-175-117-125(156)166-57-170-130(117)212)199-277(237,290)252-50-94-83(34-111(267-94)215-65-178-120-133(215)183-144(159)187-140(120)224)202-280(240,293)254-52-96-84(35-112(269-96)216-66-179-121-134(216)184-145(160)188-141(121)225)203-281(241,294)253-51-95-81(32-109(268-95)213-63-176-118-131(213)181-142(157)185-138(118)222)200-278(238,291)246-44-88-74(25-102(260-88)205-37-67(2)135(219)189-147(205)227)193-272(232,285)245-43-87-75(26-103(259-87)206-38-68(3)136(220)190-148(206)228)194-273(233,286)248-46-90-79(30-107(263-90)211-61-174-116-124(155)165-56-169-129(116)211)198-276(236,289)251-49-93-82(33-110(266-93)214-64-177-119-132(214)182-143(158)186-139(119)223)201-279(239,292)250-48-92-78(29-106(265-92)210-60-173-115-123(154)164-55-168-128(115)210)197-275(235,288)244-42-86-73(24-101(258-86)204-22-20-98(152)180-146(204)226)192-271(231,284)247-45-89-77(28-105(262-89)209-59-172-114-122(153)163-54-167-127(114)209)196-270(230,283)243-41-85-72(151)23-100(257-85)208-58-171-113-71(150)19-21-161-126(113)208/h19-22,37-39,54-66,70,72-97,100-112,217H,5-18,23-36,40-53,151H2,1-4H3,(H2,150,161)(H,162,218)(H,242,295)(H2,152,180,226)(H2,153,163,167)(H2,154,164,168)(H2,155,165,169)(H2,156,166,170)(H,189,219,227)(H,190,220,228)(H,191,221,229)(H2,192,231,284)(H2,193,232,285)(H2,194,233,286)(H2,195,234,287)(H2,196,230,283)(H2,197,235,288)(H2,198,236,289)(H2,199,237,290)(H2,200,238,291)(H2,201,239,292)(H2,202,240,293)(H2,203,241,294)(H3,157,181,185,222)(H3,158,182,186,223)(H3,159,183,187,224)(H3,160,184,188,225)/t70?,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,270?,271?,272?,273?,274?,275?,276?,277?,278?,279?,280?,281?,282?/m1/s1
• InChIKey: YUDSSVSJCFADFH-GLQDMMPFSA-N
• XLogP: -1.45
• TPSA: 1650.97 Ų
• H-Bond Donors: 45
• H-Bond Acceptors: 100
• Rotatable Bonds: 95
• Heavy Atoms: 295
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4609.28
LogP ≤ 5	-1.45
H-Bond Donors ≤ 5	45
H-Bond Acceptors ≤ 10	100

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide?

The IUPAC name of N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide (CID 162016351) is N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide.

What is the SMILES notation for N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide?

The canonical SMILES for N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide is CCCCCCCCCCCCCCCC(=O)NCC(O)COP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@H]1NP(O)(=S)OC[C@H]1O[C@@H](n2cnc3c(N)ccnc32)C[C@H]1N.

What is the InChIKey of N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide?

The InChIKey is YUDSSVSJCFADFH-GLQDMMPFSA-N. The full InChI is InChI=1S/C149H212N67O53P13S13/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-99(218)162-36-70(217)40-255-282(242,295)256-53-97-76(27-104(261-97)207-39-69(4)137(221)191-149(207)229)195-274(234,287)249-47-91-80(31-108(264-91)212-62-175-117-125(156)166-57-170-130(117)212)199-277(237,290)252-50-94-83(34-111(267-94)215-65-178-120-133(215)183-144(159)187-140(120)224)202-280(240,293)254-52-96-84(35-112(269-96)216-66-179-121-134(216)184-145(160)188-141(121)225)203-281(241,294)253-51-95-81(32-109(268-95)213-63-176-118-131(213)181-142(157)185-138(118)222)200-278(238,291)246-44-88-74(25-102(260-88)205-37-67(2)135(219)189-147(205)227)193-272(232,285)245-43-87-75(26-103(259-87)206-38-68(3)136(220)190-148(206)228)194-273(233,286)248-46-90-79(30-107(263-90)211-61-174-116-124(155)165-56-169-129(116)211)198-276(236,289)251-49-93-82(33-110(266-93)214-64-177-119-132(214)182-143(158)186-139(119)223)201-279(239,292)250-48-92-78(29-106(265-92)210-60-173-115-123(154)164-55-168-128(115)210)197-275(235,288)244-42-86-73(24-101(258-86)204-22-20-98(152)180-146(204)226)192-271(231,284)247-45-89-77(28-105(262-89)209-59-172-114-122(153)163-54-167-127(114)209)196-270(230,283)243-41-85-72(151)23-100(257-85)208-58-171-113-71(150)19-21-161-126(113)208/h19-22,37-39,54-66,70,72-97,100-112,217H,5-18,23-36,40-53,151H2,1-4H3,(H2,150,161)(H,162,218)(H,242,295)(H2,152,180,226)(H2,153,163,167)(H2,154,164,168)(H2,155,165,169)(H2,156,166,170)(H,189,219,227)(H,190,220,228)(H,191,221,229)(H2,192,231,284)(H2,193,232,285)(H2,194,233,286)(H2,195,234,287)(H2,196,230,283)(H2,197,235,288)(H2,198,236,289)(H2,199,237,290)(H2,200,238,291)(H2,201,239,292)(H2,202,240,293)(H2,203,241,294)(H3,157,181,185,222)(H3,158,182,186,223)(H3,159,183,187,224)(H3,160,184,188,225)/t70?,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,270?,271?,272?,273?,274?,275?,276?,277?,278?,279?,280?,281?,282?/m1/s1.

What are the key properties of N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide?

N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide has a molecular weight of 4609.28 g/mol, XLogP of -1.45, 95 rotatable bonds, 45 hydrogen bond donors, and 100 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-[[[(2S,3R,5R)-3-amino-5-(7-aminoimidazo[4,5-b]pyridin-3-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide is sourced from PubChem (CID 162016351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).