5'-d[catcgccgatgcggggcgatc]-3' phosphorothioate oligonucleotide

Structural Information

Molecular Formula

C₂₀₃H₂₅₆N₈₂O₁₀₄P₂₀S₂₀

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5COP(=S)(O)OC6CC(OC6COP(=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(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1CO)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C203H256N82O104P20S20/c1-77-39-272(201(306)262-175(77)288)136-25-87(376-390(309,410)329-43-102-80(287)18-129(350-102)265-11-4-122(204)239-194(265)299)108(356-136)49-336-402(321,422)380-91-29-140(276-67-229-151-162(212)223-64-226-165(151)276)360-112(91)53-339-405(324,425)386-97-35-146(282-73-235-157-171(282)250-190(218)258-182(157)295)364-116(97)57-343-395(314,415)374-86-24-135(271-17-10-128(210)245-200(271)305)355-107(86)48-335-401(320,421)384-95-33-144(280-71-233-155-169(280)248-188(216)256-180(155)293)367-119(95)60-346-408(327,428)388-99-37-148(284-75-237-159-173(284)252-192(220)260-184(159)297)369-121(99)62-348-409(328,429)389-100-38-149(285-76-238-160-174(285)253-193(221)261-185(160)298)368-120(100)61-347-407(326,427)387-98-36-147(283-74-236-158-172(283)251-191(219)259-183(158)296)365-117(98)58-344-396(315,416)375-85-23-134(270-16-9-127(209)244-199(270)304)354-106(85)47-334-400(319,420)383-94-32-143(279-70-232-154-168(279)247-187(215)255-179(154)292)366-118(94)59-345-398(317,418)378-89-27-138(274-41-79(3)177(290)264-203(274)308)358-110(89)51-338-404(323,424)381-92-30-141(277-68-230-152-163(213)224-65-227-166(152)277)361-113(92)54-340-406(325,426)385-96-34-145(281-72-234-156-170(281)249-189(217)257-181(156)294)363-115(96)56-342-393(312,413)372-83-21-132(268-14-7-125(207)242-197(268)302)351-103(83)44-331-392(311,412)371-82-20-131(267-13-6-124(206)241-196(267)301)353-105(82)46-333-399(318,419)382-93-31-142(278-69-231-153-167(278)246-186(214)254-178(153)291)362-114(93)55-341-394(313,414)373-84-22-133(269-15-8-126(208)243-198(269)303)352-104(84)45-332-397(316,417)377-88-26-137(273-40-78(2)176(289)263-202(273)307)357-109(88)50-337-403(322,423)379-90-28-139(275-66-228-150-161(211)222-63-225-164(150)275)359-111(90)52-330-391(310,411)370-81-19-130(349-101(81)42-286)266-12-5-123(205)240-195(266)300/h4-17,39-41,63-76,80-121,129-149,286-287H,18-38,42-62H2,1-3H3,(H,309,410)(H,310,411)(H,311,412)(H,312,413)(H,313,414)(H,314,415)(H,315,416)(H,316,417)(H,317,418)(H,318,419)(H,319,420)(H,320,421)(H,321,422)(H,322,423)(H,323,424)(H,324,425)(H,325,426)(H,326,427)(H,327,428)(H,328,429)(H2,204,239,299)(H2,205,240,300)(H2,206,241,301)(H2,207,242,302)(H2,208,243,303)(H2,209,244,304)(H2,210,245,305)(H2,211,222,225)(H2,212,223,226)(H2,213,224,227)(H,262,288,306)(H,263,289,307)(H,264,290,308)(H3,214,246,254,291)(H3,215,247,255,292)(H3,216,248,256,293)(H3,217,249,257,294)(H3,218,250,258,295)(H3,219,251,259,296)(H3,220,252,260,297)(H3,221,253,261,298)

InChIKey

MQUQNIFTLYWTMS-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16133525