T30677 oligonucleotide

Structural Information

Molecular Formula

C₁₇₀H₂₁₂N₆₄O₁₀₅P₁₆S₂

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(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(=S)(O)OC1CC(OC1CO)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C170H212N64O105P16S2/c1-59-25-218(164(254)211-137(59)237)100-8-66(236)84(308-100)33-305-354(289,356)339-82-24-116(234-58-190-126-136(234)200-163(180)210-153(126)253)323-98(82)47-304-353(287,288)337-81-23-115(233-57-189-125-135(233)199-162(179)209-152(125)252)317-92(81)41-298-344(269,270)327-71-13-104(222-29-63(5)141(241)215-168(222)258)310-86(71)35-292-341(263,264)325-69-11-102(220-27-61(3)139(239)213-166(220)256)312-88(69)37-294-347(275,276)331-75-17-109(227-51-183-119-129(227)193-156(173)203-146(119)246)321-96(75)45-302-352(285,286)336-80-22-114(232-56-188-124-134(232)198-161(178)208-151(124)251)322-97(80)46-303-350(281,282)334-78-20-112(230-54-186-122-132(230)196-159(176)206-149(122)249)316-91(78)40-297-343(267,268)328-72-14-105(223-30-64(6)142(242)216-169(223)259)313-89(72)38-295-348(277,278)332-76-18-110(228-52-184-120-130(228)194-157(174)204-147(120)247)319-94(76)43-300-349(279,280)333-77-19-111(229-53-185-121-131(229)195-158(175)205-148(121)248)315-90(77)39-296-342(265,266)326-70-12-103(221-28-62(4)140(240)214-167(221)257)309-85(70)34-291-340(261,262)324-68-10-101(219-26-60(2)138(238)212-165(219)255)311-87(68)36-293-346(273,274)330-74-16-108(226-50-182-118-128(226)192-155(172)202-145(118)245)320-95(74)44-301-351(283,284)335-79-21-113(231-55-187-123-133(231)197-160(177)207-150(123)250)318-93(79)42-299-345(271,272)329-73-15-106(224-31-65(7)143(243)217-170(224)260)314-99(73)48-306-355(290,357)338-67-9-107(307-83(67)32-235)225-49-181-117-127(225)191-154(171)201-144(117)244/h25-31,49-58,66-116,235-236H,8-24,32-48H2,1-7H3,(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,289,356)(H,290,357)(H,211,237,254)(H,212,238,255)(H,213,239,256)(H,214,240,257)(H,215,241,258)(H,216,242,259)(H,217,243,260)(H3,171,191,201,244)(H3,172,192,202,245)(H3,173,193,203,246)(H3,174,194,204,247)(H3,175,195,205,248)(H3,176,196,206,249)(H3,177,197,207,250)(H3,178,198,208,251)(H3,179,199,209,252)(H3,180,200,210,253)

InChIKey

HVOOIYLFKWIXPT-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-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-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]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-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]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]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl [2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16130332