Cactgcgcccatagtgct

Structural Information

Molecular Formula

C₁₇₃H₂₂₂N₆₄O₁₁₀P₁₈

SMILES

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

InChI

InChI=1S/C173H222N64O110P18/c1-69-37-227(170(254)216-151(69)239)116-19-73(238)91(313-116)41-296-349(261,262)332-75-21-118(221-13-6-110(175)202-164(221)248)315-93(75)43-300-360(283,284)345-88-34-131(235-66-198-138-148(235)209-160(185)213-156(138)244)328-106(88)56-311-358(279,280)340-83-29-126(230-40-72(4)154(242)219-173(230)257)323-101(83)51-305-364(291,292)347-90-36-133(237-68-200-140-150(237)211-162(187)215-158(140)246)330-108(90)58-312-365(293,294)343-86-32-129(233-64-196-136-143(183)190-61-193-146(136)233)326-104(86)54-308-356(275,276)338-82-28-125(229-39-71(3)153(241)218-172(229)256)322-100(82)50-304-363(289,290)342-85-31-128(232-63-195-135-142(182)189-60-192-145(135)232)325-103(85)53-307-354(271,272)336-79-25-122(225-17-10-114(179)206-168(225)252)317-95(79)45-298-351(265,266)333-76-22-119(222-14-7-111(176)203-165(222)249)316-94(76)44-297-352(267,268)334-77-23-120(223-15-8-112(177)204-166(223)250)319-97(77)47-301-361(285,286)344-87-33-130(234-65-197-137-147(234)208-159(184)212-155(137)243)327-105(87)55-309-355(273,274)337-80-26-123(226-18-11-115(180)207-169(226)253)320-98(80)48-302-362(287,288)346-89-35-132(236-67-199-139-149(236)210-161(186)214-157(139)245)329-107(89)57-310-357(277,278)339-81-27-124(228-38-70(2)152(240)217-171(228)255)321-99(81)49-303-353(269,270)335-78-24-121(224-16-9-113(178)205-167(224)251)318-96(78)46-299-359(281,282)341-84-30-127(231-62-194-134-141(181)188-59-191-144(134)231)324-102(84)52-306-350(263,264)331-74-20-117(220-12-5-109(174)201-163(220)247)314-92(74)42-295-348(258,259)260/h5-18,37-40,59-68,73-108,116-133,238H,19-36,41-58H2,1-4H3,(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H,293,294)(H2,174,201,247)(H2,175,202,248)(H2,176,203,249)(H2,177,204,250)(H2,178,205,251)(H2,179,206,252)(H2,180,207,253)(H2,181,188,191)(H2,182,189,192)(H2,183,190,193)(H,216,239,254)(H,217,240,255)(H,218,241,256)(H,219,242,257)(H2,258,259,260)(H3,184,208,212,243)(H3,185,209,213,244)(H3,186,210,214,245)(H3,187,211,215,246)

InChIKey

IBVRKOPKYLRGOT-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(4-amino-2-oxopyrimidin-1-yl)-3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxyoxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16197284