5'-dttcgtcttacctttgctt-3', phosphorothioate oligodeoxynucleotide

Structural Information

Molecular Formula

C₁₇₅H₂₂₇N₅₀O₉₈P₁₇S₁₇

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=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=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=CC(=NC1=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=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)O

InChI

InChI=1S/C175H227N50O98P17S17/c1-71-39-213(166(245)198-147(71)228)122-21-81(227)100(290-122)50-272-324(255,341)313-88-28-129(215-41-73(3)149(230)200-168(215)247)297-107(88)57-279-327(258,344)311-86-26-126(211-19-14-120(179)192-164(211)243)295-105(86)55-278-339(270,356)322-97-37-138(224-69-187-141-145(224)194-159(182)196-157(141)238)306-116(97)66-288-337(268,354)320-95-35-136(222-48-80(10)156(237)207-175(222)254)302-112(95)62-284-335(266,352)318-93-33-134(220-46-78(8)154(235)205-173(220)252)300-110(93)60-282-333(264,350)316-91-31-132(218-44-76(6)152(233)203-171(218)250)298-108(91)58-280-328(259,345)309-84-24-124(209-17-12-118(177)190-162(209)241)291-101(84)51-274-326(257,343)308-83-23-123(208-16-11-117(176)189-161(208)240)294-104(83)54-277-338(269,355)321-96-36-137(223-68-186-140-143(181)184-67-185-144(140)223)304-114(96)64-286-336(267,353)319-94-34-135(221-47-79(9)155(236)206-174(221)253)301-111(94)61-283-334(265,351)317-92-32-133(219-45-77(7)153(234)204-172(219)251)299-109(92)59-281-329(260,346)310-85-25-125(210-18-13-119(178)191-163(210)242)292-102(85)52-276-332(263,349)315-90-30-131(217-43-75(5)151(232)202-170(217)249)303-113(90)63-285-340(271,357)323-98-38-139(225-70-188-142-146(225)195-160(183)197-158(142)239)305-115(98)65-287-330(261,347)312-87-27-127(212-20-15-121(180)193-165(212)244)293-103(87)53-275-331(262,348)314-89-29-130(216-42-74(4)150(231)201-169(216)248)296-106(89)56-273-325(256,342)307-82-22-128(289-99(82)49-226)214-40-72(2)148(229)199-167(214)246/h11-20,39-48,67-70,81-116,122-139,226-227H,21-38,49-66H2,1-10H3,(H,255,341)(H,256,342)(H,257,343)(H,258,344)(H,259,345)(H,260,346)(H,261,347)(H,262,348)(H,263,349)(H,264,350)(H,265,351)(H,266,352)(H,267,353)(H,268,354)(H,269,355)(H,270,356)(H,271,357)(H2,176,189,240)(H2,177,190,241)(H2,178,191,242)(H2,179,192,243)(H2,180,193,244)(H2,181,184,185)(H,198,228,245)(H,199,229,246)(H,200,230,247)(H,201,231,248)(H,202,232,249)(H,203,233,250)(H,204,234,251)(H,205,235,252)(H,206,236,253)(H,207,237,254)(H3,182,194,196,238)(H3,183,195,197,239)

InChIKey

YPCJEANTHBWVRY-UHFFFAOYSA-N

Compound name

1-[5-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-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]-5-(4-amino-2-oxopyrimidin-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]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-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]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)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 16131559