[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methyl [5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Structural Information

Molecular Formula

C₂₁₃H₂₈₁N₇₈O₉₆P₁₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(C)OC3CC(OC3COP(=O)(C)OC4CC(OC4COP(=O)(C)OC5CC(OC5COP(=O)(C)OC6CC(OC6COP(=O)(C)OC7CC(OC7COP(=O)(C)OC8CC(OC8COP(=O)(C)OC9CC(OC9COP(=O)(C)OC1CC(OC1COP(=O)(C)OC1CC(OC1COP(=O)(C)OC1CC(OC1COP(=O)(O)OC1CC(OC1CO)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(C)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C213H281N78O96P19/c1-96-53-277(210(306)268-195(96)294)151-40-107(127(357-151)64-336-395(12,317)375-108-41-152(278-54-97(2)196(295)269-211(278)307)358-128(108)65-337-399(16,321)380-112-45-157(283-87-248-167-178(221)232-79-240-186(167)283)362-132(112)69-341-401(18,323)382-114-47-159(285-89-250-169-180(223)234-81-242-188(169)285)360-130(114)67-339-392(9,314)372-105-38-149(275-31-26-143(217)260-208(275)304)352-123(105)60-332-389(6,311)369-102-35-146(272-28-23-140(214)257-205(272)301)351-122(102)59-331-390(7,312)370-103-36-147(273-29-24-141(215)258-206(273)302)354-125(103)62-334-398(15,320)379-111-44-156(282-86-247-166-177(220)231-78-239-185(166)282)361-131(111)68-340-393(10,315)373-106-39-150(276-32-27-144(218)261-209(276)305)355-139(106)76-348-406(328,329)387-101-34-155(349-120(101)57-292)281-85-246-165-176(219)230-77-238-184(165)281)374-394(11,316)333-61-124-104(37-148(353-124)274-30-25-142(216)259-207(274)303)371-391(8,313)335-63-126-109(42-153(356-126)279-55-98(3)197(296)270-212(279)308)376-397(14,319)347-75-138-119(52-164(368-138)291-95-256-175-194(291)264-204(229)267-201(175)300)386-405(22,327)345-73-136-117(50-162(366-136)288-92-253-172-183(226)237-84-245-191(172)288)385-404(21,326)344-72-135-116(49-161(365-135)287-91-252-171-182(225)236-83-244-190(171)287)384-403(20,325)343-71-134-115(48-160(364-134)286-90-251-170-181(224)235-82-243-189(170)286)383-402(19,324)342-70-133-113(46-158(363-133)284-88-249-168-179(222)233-80-241-187(168)284)381-400(17,322)338-66-129-110(43-154(359-129)280-56-99(4)198(297)271-213(280)309)377-396(13,318)346-74-137-118(51-163(367-137)290-94-255-174-193(290)263-203(228)266-200(174)299)378-388(5,310)330-58-121-100(293)33-145(350-121)289-93-254-173-192(289)262-202(227)265-199(173)298/h23-32,53-56,77-95,100-139,145-164,292-293H,33-52,57-76H2,1-22H3,(H,328,329)(H2,214,257,301)(H2,215,258,302)(H2,216,259,303)(H2,217,260,304)(H2,218,261,305)(H2,219,230,238)(H2,220,231,239)(H2,221,232,240)(H2,222,233,241)(H2,223,234,242)(H2,224,235,243)(H2,225,236,244)(H2,226,237,245)(H,268,294,306)(H,269,295,307)(H,270,296,308)(H,271,297,309)(H3,227,262,265,298)(H3,228,263,266,299)(H3,229,264,267,300)

InChIKey

MQTKVTKJFUUHCT-UHFFFAOYSA-N

Compound name

[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methyl [5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16197372