Mismatched tar16m

Structural Information

Molecular Formula

C₁₆₆H₂₁₀N₅₇O₁₁₀P₁₅

SMILES

COC1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)(O)OC3C4C(OC3(CO4)COP(=O)(O)OC5C(OC(C5OC)N6C=NC7=C(N=CN=C76)N)COP(=O)(O)OC8C(OC(C8OC)N9C=NC1=C9N=C(NC1=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C(N=CN=C21)N)COP(=O)(O)OC1C2C(OC1(CO2)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=O)NC1=O)COP(=O)(O)OC1C2C(OC1(CO2)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C(N=CN=C21)N)COP(=O)(O)OC1C2C(OC1(CO2)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=O)(O)OC1C2C(OC1(CO2)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=O)NC1=O)COP(=O)(O)OC1C2C(OC1(CO2)CO)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=O)NC1=O)O

InChI

InChI=1S/C166H210N57O110P15/c1-272-98-88(228)62(303-132(98)208-21-11-72(167)192-151(208)232)31-288-338(250,251)329-119-113-147(217-30-20-81(227)201-160(217)241)318-166(119,47-287-113)52-302-346(266,267)325-95-67(307-138(104(95)278-7)220-58-188-84-122(176)182-55-185-125(84)220)33-290-337(248,249)322-94-66(310-139(105(94)279-8)221-59-189-85-126(221)202-148(177)205-129(85)229)32-289-335(244,245)320-92-70(308-136(102(92)276-5)218-56-186-82-120(174)180-53-183-123(82)218)39-296-342(258,259)332-117-111-145(215-26-16-77(172)197-156(215)237)315-163(117,44-284-111)49-299-345(264,265)324-91-65(306-135(101(91)275-4)211-29-19-80(226)200-159(211)240)38-295-341(256,257)331-116-110-144(214-25-15-76(171)196-155(214)236)316-164(116,45-285-110)50-300-348(270,271)327-97-69(312-141(107(97)281-10)223-61-191-87-128(223)204-150(179)207-131(87)231)35-292-336(246,247)321-93-71(309-137(103(93)277-6)219-57-187-83-121(175)181-54-184-124(83)219)40-297-343(260,261)333-118-112-146(216-27-17-78(173)198-157(216)238)317-165(118,46-286-112)51-301-347(268,269)326-96-68(311-140(106(96)280-9)222-60-190-86-127(222)203-149(178)206-130(86)230)34-291-334(242,243)319-89-63(304-133(99(89)273-2)209-22-12-73(168)193-152(209)233)36-294-340(254,255)330-115-109-143(213-24-14-75(170)195-154(213)235)314-162(115,43-283-109)48-298-344(262,263)323-90-64(305-134(100(90)274-3)210-28-18-79(225)199-158(210)239)37-293-339(252,253)328-114-108-142(313-161(114,41-224)42-282-108)212-23-13-74(169)194-153(212)234/h11-30,53-71,88-119,132-147,224,228H,31-52H2,1-10H3,(H,242,243)(H,244,245)(H,246,247)(H,248,249)(H,250,251)(H,252,253)(H,254,255)(H,256,257)(H,258,259)(H,260,261)(H,262,263)(H,264,265)(H,266,267)(H,268,269)(H,270,271)(H2,167,192,232)(H2,168,193,233)(H2,169,194,234)(H2,170,195,235)(H2,171,196,236)(H2,172,197,237)(H2,173,198,238)(H2,174,180,183)(H2,175,181,184)(H2,176,182,185)(H,199,225,239)(H,200,226,240)(H,201,227,241)(H3,177,202,205,229)(H3,178,203,206,230)(H3,179,204,207,231)

InChIKey

QSSNLAINNCIEQQ-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[1-[[[2-[[[1-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[1-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[3-(4-amino-2-oxopyrimidin-1-yl)-1-[[[2-[[[3-(4-amino-2-oxopyrimidin-1-yl)-1-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-3-(4-amino-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-3-(4-amino-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-3-(4-amino-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-4-methoxyoxolan-3-yl] [3-[[7-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)-4-methoxyoxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16186192