5'-dctttgaggtttaggattcgtgctcatg-3', phosphorothioate oligodeoxynucleotide

Structural Information

Molecular Formula

C₂₆₆H₃₃₆N₉₄O₁₄₁P₂₆S₂₆

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3CO)N4C=CC(=NC4=O)N)OP(=S)(O)OCC5C(CC(O5)N6C=C(C(=O)NC6=O)C)OP(=S)(O)OCC7C(CC(O7)N8C=C(C(=O)NC8=O)C)OP(=S)(O)OCC9C(CC(O9)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O)S

InChI

InChI=1S/C266H336N94O141P26S26/c1-101-47-338(256(386)323-225(101)363)175-25-117(480-502(397,528)423-59-140-112(362)20-170(450-140)353-93-295-201-217(353)307-244(275)315-236(201)374)145(455-175)64-434-518(413,544)491-128-36-186(349-89-291-197-209(271)283-85-287-213(197)349)465-155(128)74-438-505(400,531)478-115-23-173(336-18-14-168(269)305-254(336)384)451-141(115)60-425-507(402,533)481-119-27-177(340-49-103(3)227(365)325-258(340)388)456-146(119)65-428-504(399,530)477-114-22-172(335-17-13-167(268)304-253(335)383)453-143(114)62-427-517(412,543)495-132-40-190(354-94-296-202-218(354)308-245(276)316-237(202)375)470-160(132)79-443-516(411,542)490-127-35-185(348-57-111(11)235(373)333-266(348)396)464-154(127)73-437-520(415,546)496-133-41-191(355-95-297-203-219(355)309-246(277)317-238(203)376)469-159(133)78-442-506(401,532)479-116-24-174(337-19-15-169(270)306-255(337)385)452-142(116)61-426-508(403,534)482-120-28-178(341-50-104(4)228(366)326-259(341)389)457-147(120)66-430-512(407,538)486-123-31-181(344-53-107(7)231(369)329-262(344)392)462-152(123)71-435-519(414,545)492-129-37-187(350-90-292-198-210(272)284-86-288-214(198)350)467-157(129)76-440-525(420,551)499-136-44-194(358-98-300-206-222(358)312-249(280)320-241(206)379)475-165(136)84-448-527(422,553)501-138-46-196(360-100-302-208-224(360)314-251(282)322-243(208)381)472-162(138)81-445-522(417,548)493-130-38-188(351-91-293-199-211(273)285-87-289-215(199)351)466-156(130)75-439-514(409,540)488-125-33-183(346-55-109(9)233(371)331-264(346)394)460-150(125)69-432-510(405,536)485-122-30-180(343-52-106(6)230(368)328-261(343)391)459-149(122)68-431-513(408,539)487-124-32-182(345-54-108(8)232(370)330-263(345)393)463-153(124)72-436-521(416,547)497-134-42-192(356-96-298-204-220(356)310-247(278)318-239(204)377)474-164(134)83-447-526(421,552)500-137-45-195(359-99-301-207-223(359)313-250(281)321-242(207)380)473-163(137)82-446-523(418,549)494-131-39-189(352-92-294-200-212(274)286-88-290-216(200)352)468-158(131)77-441-524(419,550)498-135-43-193(357-97-299-205-221(357)311-248(279)319-240(205)378)471-161(135)80-444-515(410,541)489-126-34-184(347-56-110(10)234(372)332-265(347)395)461-151(126)70-433-511(406,537)484-121-29-179(342-51-105(5)229(367)327-260(342)390)458-148(121)67-429-509(404,535)483-118-26-176(339-48-102(2)226(364)324-257(339)387)454-144(118)63-424-503(398,529)476-113-21-171(449-139(113)58-361)334-16-12-166(267)303-252(334)382/h12-19,47-57,85-100,112-165,170-196,361-362H,20-46,58-84H2,1-11H3,(H,397,528)(H,398,529)(H,399,530)(H,400,531)(H,401,532)(H,402,533)(H,403,534)(H,404,535)(H,405,536)(H,406,537)(H,407,538)(H,408,539)(H,409,540)(H,410,541)(H,411,542)(H,412,543)(H,413,544)(H,414,545)(H,415,546)(H,416,547)(H,417,548)(H,418,549)(H,419,550)(H,420,551)(H,421,552)(H,422,553)(H2,267,303,382)(H2,268,304,383)(H2,269,305,384)(H2,270,306,385)(H2,271,283,287)(H2,272,284,288)(H2,273,285,289)(H2,274,286,290)(H,323,363,386)(H,324,364,387)(H,325,365,388)(H,326,366,389)(H,327,367,390)(H,328,368,391)(H,329,369,392)(H,330,370,393)(H,331,371,394)(H,332,372,395)(H,333,373,396)(H3,275,307,315,374)(H3,276,308,316,375)(H3,277,309,317,376)(H3,278,310,318,377)(H3,279,311,319,378)(H3,280,312,320,379)(H3,281,313,321,380)(H3,282,314,322,381)

InChIKey

XZCBQECEDDNUPM-UHFFFAOYSA-N

Compound name

1-[4-[[3-[[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-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16131578