S-odn-2

Structural Information

Molecular Formula

C₁₃₇H₁₆₉N₆₄O₆₄P₁₃S₁₃

SMILES

C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=S)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5COP(=S)(O)OC6CC(OC6COP(=S)(O)OC7CC(OC7COP(=S)(O)OC8CC(OC8COP(=S)(O)OC9CC(OC9COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=O)(OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1CO)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)S)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C137H169N64O64P13S13/c138-79-1-4-188(135(210)173-79)83-9-53(67(241-83)23-228-271(218,284)258-57-13-87(193-42-164-98-109(143)154-37-159-114(98)193)246-72(57)28-234-278(225,291)265-64-20-95(201-50-172-106-122(201)181-134(151)187-128(106)209)252-78(64)34-238-275(222,288)261-59-15-89(195-44-166-100-111(145)156-39-161-116(100)195)247-73(59)29-232-276(223,289)263-61-17-92(198-47-169-103-119(198)178-131(148)184-125(103)206)248-74(61)30-227-267(214,280)253-52-8-90(239-65(52)21-202)196-45-167-101-117(196)176-129(146)182-123(101)204)254-268(215,281)231-26-70-58(14-88(244-70)194-43-165-99-110(144)155-38-160-115(99)194)260-274(221,287)237-33-77-62(18-93(251-77)199-48-170-104-120(199)179-132(149)185-126(104)207)262-273(220,286)230-25-69-55(11-85(243-69)190-6-3-81(140)175-137(190)212)256-270(217,283)236-32-76-63(19-94(250-76)200-49-171-105-121(200)180-133(150)186-127(105)208)264-277(224,290)233-27-71-56(12-86(245-71)192-41-163-97-108(142)153-36-158-113(97)192)259-272(219,285)229-24-68-54(10-84(242-68)189-5-2-80(139)174-136(189)211)255-269(216,282)235-31-75-60(16-91(249-75)197-46-168-102-118(197)177-130(147)183-124(102)205)257-266(213,279)226-22-66-51(203)7-82(240-66)191-40-162-96-107(141)152-35-157-112(96)191/h1-6,35-78,82-95,202-203H,7-34H2,(H,213,279)(H,214,280)(H,215,281)(H,216,282)(H,217,283)(H,218,284)(H,219,285)(H,220,286)(H,221,287)(H,222,288)(H,223,289)(H,224,290)(H,225,291)(H2,138,173,210)(H2,139,174,211)(H2,140,175,212)(H2,141,152,157)(H2,142,153,158)(H2,143,154,159)(H2,144,155,160)(H2,145,156,161)(H3,146,176,182,204)(H3,147,177,183,205)(H3,148,178,184,206)(H3,149,179,185,207)(H3,150,180,186,208)(H3,151,181,187,209)

InChIKey

NONZDLVTZDDBQM-UHFFFAOYSA-N

Compound name

2-amino-9-[4-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

Related CIDs

• CID 16204553