Aggtatctttccacagcc

Structural Information

Molecular Formula

C₁₇₄H₂₂₃N₆₃O₁₁₀P₁₈

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)O)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C174H223N63O110P18/c1-70-36-226(170(253)215-153(70)239)123-24-81(336-354(271,272)298-45-97-77(20-119(316-97)222-14-8-113(177)205-166(222)249)332-350(263,264)297-44-96-79(22-121(315-96)224-16-10-115(179)207-168(224)251)334-352(267,268)307-53-105-87(30-129(325-105)232-64-197-136-143(182)189-60-193-147(136)232)342-360(283,284)300-47-99-80(23-122(318-99)225-17-11-116(180)208-169(225)252)335-353(269,270)308-54-106-89(32-131(326-106)234-66-199-138-145(184)191-62-195-149(138)234)344-364(291,292)311-57-109-90(33-132(329-109)235-67-200-139-150(235)209-161(185)212-158(139)244)345-361(285,286)301-43-95-76(19-118(314-95)221-13-7-112(176)204-165(221)248)331-349(261,262)296-41-93-75(238)18-117(313-93)220-12-6-111(175)203-164(220)247)101(320-123)49-303-357(277,278)339-84-27-126(229-39-73(4)156(242)218-173(229)256)321-102(84)50-304-356(275,276)338-83-26-125(228-38-72(3)155(241)217-172(228)255)319-100(83)48-302-351(265,266)333-78-21-120(223-15-9-114(178)206-167(223)250)317-98(78)46-299-355(273,274)337-82-25-124(227-37-71(2)154(240)216-171(227)254)322-103(82)51-305-362(287,288)343-88-31-130(233-65-198-137-144(183)190-61-194-148(137)233)327-107(88)55-309-358(279,280)340-85-28-127(230-40-74(5)157(243)219-174(230)257)323-104(85)52-306-363(289,290)346-91-34-133(236-68-201-140-151(236)210-162(186)213-159(140)245)330-110(91)58-312-365(293,294)347-92-35-134(237-69-202-141-152(237)211-163(187)214-160(141)246)328-108(92)56-310-359(281,282)341-86-29-128(324-94(86)42-295-348(258,259)260)231-63-196-135-142(181)188-59-192-146(135)231/h6-17,36-40,59-69,75-110,117-134,238H,18-35,41-58H2,1-5H3,(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)(H2,175,203,247)(H2,176,204,248)(H2,177,205,249)(H2,178,206,250)(H2,179,207,251)(H2,180,208,252)(H2,181,188,192)(H2,182,189,193)(H2,183,190,194)(H2,184,191,195)(H,215,239,253)(H,216,240,254)(H,217,241,255)(H,218,242,256)(H,219,243,257)(H2,258,259,260)(H3,185,209,212,244)(H3,186,210,213,245)(H3,187,211,214,246)

InChIKey

LSPDOHQPPFMJOO-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16197301