Actcttgcctggagctgc

Structural Information

Molecular Formula

C₁₇₄H₂₂₃N₆₃O₁₁₂P₁₈

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)O)N5C=NC6=C(N=CN=C65)N)N7C=CC(=NC7=O)N)OP(=O)(O)OCC8C(CC(O8)N9C=CC(=NC9=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=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)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=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=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C174H223N63O112P18/c1-68-36-226(170(255)215-149(68)239)121-24-79(98(321-121)48-304-355(271,272)336-77-22-119(224-16-10-113(179)203-168(224)253)318-95(77)45-301-362(285,286)343-84-29-126(326-92(84)42-297-350(260,261)262)231-61-192-133-140(181)188-59-190-142(133)231)338-357(275,276)300-44-94-76(21-118(317-94)223-15-9-112(178)202-167(223)252)335-354(269,270)305-49-99-80(25-122(322-99)227-37-69(2)150(240)216-171(227)256)339-358(277,278)308-52-102-83(28-125(325-102)230-40-72(5)153(243)219-174(230)259)342-361(283,284)311-55-105-87(32-129(329-105)234-64-195-136-145(234)206-160(184)211-155(136)245)346-363(287,288)302-46-96-74(19-116(319-96)221-13-7-110(176)200-165(221)250)333-352(265,266)299-43-93-75(20-117(316-93)222-14-8-111(177)201-166(222)251)334-353(267,268)306-51-101-82(27-124(324-101)229-39-71(4)152(242)218-173(229)258)341-360(281,282)312-56-106-89(34-131(330-106)236-66-197-138-147(236)208-162(186)213-157(138)247)349-367(295,296)314-58-108-90(35-132(332-108)237-67-198-139-148(237)209-163(187)214-158(139)248)348-366(293,294)309-53-103-85(30-127(327-103)232-62-193-134-141(182)189-60-191-143(134)232)345-365(291,292)313-57-107-88(33-130(331-107)235-65-196-137-146(235)207-161(185)212-156(137)246)347-364(289,290)303-47-97-78(23-120(320-97)225-17-11-114(180)204-169(225)254)337-356(273,274)307-50-100-81(26-123(323-100)228-38-70(3)151(241)217-172(228)257)340-359(279,280)310-54-104-86(31-128(328-104)233-63-194-135-144(233)205-159(183)210-154(135)244)344-351(263,264)298-41-91-73(238)18-115(315-91)220-12-6-109(175)199-164(220)249/h6-17,36-40,59-67,73-108,115-132,238H,18-35,41-58H2,1-5H3,(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)(H,295,296)(H2,175,199,249)(H2,176,200,250)(H2,177,201,251)(H2,178,202,252)(H2,179,203,253)(H2,180,204,254)(H2,181,188,190)(H2,182,189,191)(H,215,239,255)(H,216,240,256)(H,217,241,257)(H,218,242,258)(H,219,243,259)(H2,260,261,262)(H3,183,205,210,244)(H3,184,206,211,245)(H3,185,207,212,246)(H3,186,208,213,247)(H3,187,209,214,248)

InChIKey

KKSNMNPLMURUCA-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16197300