Dn18t

Structural Information

Molecular Formula

C₁₇₃H₂₂₁N₆₄O₁₀₉P₁₇

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3CO)N4C=NC5=C4N=C(NC5=O)N)OP(=O)(O)OCC6C(CC(O6)N7C=CC(=NC7=O)N)OP(=O)(O)OCC8C(CC(O8)N9C=CC(=NC9=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=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=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=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)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)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C173H221N64O109P17/c1-67-37-227(170(257)216-147(67)240)122-28-80(98(321-122)50-296-348(263,264)330-72-20-126(312-89(72)41-238)232-61-191-133-141(232)204-157(182)210-151(133)244)338-355(277,278)300-46-94-75(23-117(317-94)222-14-7-109(176)199-165(222)252)333-351(269,270)298-44-92-74(22-116(315-92)221-13-6-108(175)198-164(221)251)332-350(267,268)299-45-93-77(25-119(316-93)224-16-9-111(178)201-167(224)254)335-352(271,272)304-51-99-83(31-125(322-99)230-40-70(4)150(243)219-173(230)260)341-358(283,284)309-56-104-86(34-129(327-104)235-64-194-136-144(235)207-160(185)213-154(136)247)344-361(289,290)306-53-101-82(30-124(324-101)229-39-69(3)149(242)218-172(229)259)340-357(281,282)305-52-100-81(29-123(323-100)228-38-68(2)148(241)217-171(228)258)339-356(279,280)301-47-95-78(26-120(318-95)225-17-10-112(179)202-168(225)255)336-353(273,274)308-55-103-87(35-130(326-103)236-65-195-137-145(236)208-161(186)214-155(137)248)345-362(291,292)311-58-106-88(36-131(329-106)237-66-196-138-146(237)209-162(187)215-156(138)249)346-363(293,294)310-57-105-85(33-128(328-105)234-63-193-135-143(234)206-159(184)212-153(135)246)343-360(287,288)303-49-97-79(27-121(320-97)226-18-11-113(180)203-169(226)256)337-354(275,276)307-54-102-84(32-127(325-102)233-62-192-134-142(233)205-158(183)211-152(134)245)342-359(285,286)302-48-96-76(24-118(319-96)223-15-8-110(177)200-166(223)253)334-349(265,266)297-43-91-73(21-115(314-91)220-12-5-107(174)197-163(220)250)331-347(261,262)295-42-90-71(239)19-114(313-90)231-60-190-132-139(181)188-59-189-140(132)231/h5-18,37-40,59-66,71-106,114-131,238-239H,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)(H2,174,197,250)(H2,175,198,251)(H2,176,199,252)(H2,177,200,253)(H2,178,201,254)(H2,179,202,255)(H2,180,203,256)(H2,181,188,189)(H,216,240,257)(H,217,241,258)(H,218,242,259)(H,219,243,260)(H3,182,204,210,244)(H3,183,205,211,245)(H3,184,206,212,246)(H3,185,207,213,247)(H3,186,208,214,248)(H3,187,209,215,249)

InChIKey

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

Related CIDs

• CID 16186085