5'-dttggtgttacgtttggtt-3', phosphorothioate oligodeoxynucleotide

Structural Information

Molecular Formula

C₁₇₉H₂₂₇N₅₈O₉₈P₁₇S₁₇

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)OC4CC(OC4COP(=O)(OC5CC(OC5COP(=S)(O)OC6CC(OC6COP(=S)(O)OC7CC(OC7COP(=S)(O)OC8CC(OC8COP(=S)(O)OC9CC(OC9COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1CO)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=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)O

InChI

InChI=1S/C179H227N58O98P17S17/c1-67-31-221(170(257)210-147(67)240)114-13-77(239)96(302-114)42-284-336(267,353)321-80-16-117(223-33-69(3)149(242)212-172(223)259)305-99(80)45-290-347(278,364)332-91-27-128(234-63-193-135-143(234)200-165(184)206-159(135)252)317-111(91)57-299-351(282,368)335-94-30-131(237-66-196-138-146(237)203-168(187)209-162(138)255)316-110(94)56-298-344(275,361)327-86-22-123(229-39-75(9)155(248)218-178(229)265)308-102(86)48-289-339(270,356)322-82-18-119(225-35-71(5)151(244)214-174(225)261)306-100(82)46-287-340(271,357)323-83-19-120(226-36-72(6)152(245)215-175(226)262)309-103(83)49-291-348(279,365)330-89-25-126(232-61-191-133-141(232)198-163(182)204-157(133)250)313-107(89)53-295-338(269,355)320-79-15-115(220-12-11-113(180)197-169(220)256)303-97(79)43-286-346(277,363)329-88-24-125(231-60-190-132-139(181)188-59-189-140(132)231)312-106(88)52-294-342(273,359)326-85-21-122(228-38-74(8)154(247)217-177(228)264)307-101(85)47-288-341(272,358)324-84-20-121(227-37-73(7)153(246)216-176(227)263)310-104(84)50-292-349(280,366)331-90-26-127(233-62-192-134-142(233)199-164(183)205-158(134)251)314-108(90)54-297-345(276,362)328-87-23-124(230-40-76(10)156(249)219-179(230)266)311-105(87)51-293-350(281,367)333-92-28-129(235-64-194-136-144(235)201-166(185)207-160(136)253)318-112(92)58-300-352(283,369)334-93-29-130(236-65-195-137-145(236)202-167(186)208-161(137)254)315-109(93)55-296-343(274,360)325-81-17-118(224-34-70(4)150(243)213-173(224)260)304-98(81)44-285-337(268,354)319-78-14-116(301-95(78)41-238)222-32-68(2)148(241)211-171(222)258/h11-12,31-40,59-66,77-112,114-131,238-239H,13-30,41-58H2,1-10H3,(H,267,353)(H,268,354)(H,269,355)(H,270,356)(H,271,357)(H,272,358)(H,273,359)(H,274,360)(H,275,361)(H,276,362)(H,277,363)(H,278,364)(H,279,365)(H,280,366)(H,281,367)(H,282,368)(H,283,369)(H2,180,197,256)(H2,181,188,189)(H,210,240,257)(H,211,241,258)(H,212,242,259)(H,213,243,260)(H,214,244,261)(H,215,245,262)(H,216,246,263)(H,217,247,264)(H,218,248,265)(H,219,249,266)(H3,182,198,204,250)(H3,183,199,205,251)(H3,184,200,206,252)(H3,185,201,207,253)(H3,186,202,208,254)(H3,187,203,209,255)

InChIKey

XBPDQKNAWJQAKZ-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16131558