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

Structural Information

Molecular Formula

C₁₉₈H₂₄₅N₈₄O₁₀₁P₁₉S₁₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3CO)N4C=NC5=C4N=C(NC5=O)N)OP(=S)(O)OCC6C(CC(O6)N7C=C(C(=O)NC7=O)C)OP(=S)(O)OCC8C(CC(O8)N9C=NC1=C9N=C(NC1=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=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=CC(=NC1=O)N)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=NC2=C1N=C(NC2=O)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=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=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O)S

InChI

InChI=1S/C198H245N84O101P19S19/c1-69-29-265(195(303)259-165(69)285)118-13-77(97(349-118)37-327-385(308,404)365-74-10-124(345-93(74)33-283)272-58-222-138-154(272)236-182(204)248-170(138)290)368-388(311,407)330-38-98-79(15-120(350-98)267-31-71(3)167(287)261-197(267)305)370-390(313,409)336-45-105-86(22-128(357-105)276-62-226-142-158(276)240-186(208)252-174(142)294)379-399(322,418)341-49-109-89(25-131(361-109)279-65-229-145-161(279)243-189(211)255-177(145)297)377-396(319,415)334-42-102-82(18-123(354-102)270-56-220-136-150(202)216-54-218-152(136)270)374-394(317,413)338-47-107-88(24-130(359-107)278-64-228-144-160(278)242-188(210)254-176(144)296)376-395(318,414)333-41-101-81(17-122(353-101)269-55-219-135-149(201)215-53-217-151(135)269)373-392(315,411)329-36-96-75(11-116(348-96)263-7-5-113(199)233-193(263)301)366-386(309,405)328-35-95-76(12-117(347-95)264-8-6-114(200)234-194(264)302)367-387(310,406)335-44-104-85(21-127(356-104)275-61-225-141-157(275)239-185(207)251-173(141)293)378-398(321,417)342-51-111-92(28-134(363-111)282-68-232-148-164(282)246-192(214)258-180(148)300)383-402(325,421)344-52-112-91(27-133(364-112)281-67-231-147-163(281)245-191(213)257-179(147)299)382-401(324,420)340-48-108-84(20-126(360-108)274-60-224-140-156(274)238-184(206)250-172(140)292)375-393(316,412)332-40-100-78(14-119(352-100)266-30-70(2)166(286)260-196(266)304)369-389(312,408)331-39-99-80(16-121(351-99)268-32-72(4)168(288)262-198(268)306)371-391(314,410)337-46-106-87(23-129(358-106)277-63-227-143-159(277)241-187(209)253-175(143)295)380-400(323,419)343-50-110-90(26-132(362-110)280-66-230-146-162(280)244-190(212)256-178(146)298)381-397(320,416)339-43-103-83(19-125(355-103)273-59-223-139-155(273)237-183(205)249-171(139)291)372-384(307,403)326-34-94-73(284)9-115(346-94)271-57-221-137-153(271)235-181(203)247-169(137)289/h5-8,29-32,53-68,73-112,115-134,283-284H,9-28,33-52H2,1-4H3,(H,307,403)(H,308,404)(H,309,405)(H,310,406)(H,311,407)(H,312,408)(H,313,409)(H,314,410)(H,315,411)(H,316,412)(H,317,413)(H,318,414)(H,319,415)(H,320,416)(H,321,417)(H,322,418)(H,323,419)(H,324,420)(H,325,421)(H2,199,233,301)(H2,200,234,302)(H2,201,215,217)(H2,202,216,218)(H,259,285,303)(H,260,286,304)(H,261,287,305)(H,262,288,306)(H3,203,235,247,289)(H3,204,236,248,290)(H3,205,237,249,291)(H3,206,238,250,292)(H3,207,239,251,293)(H3,208,240,252,294)(H3,209,241,253,295)(H3,210,242,254,296)(H3,211,243,255,297)(H3,212,244,256,298)(H3,213,245,257,299)(H3,214,246,258,300)

InChIKey

ASIXETNJQOJQMW-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204842