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

Structural Information

Molecular Formula

C₁₉₅H₂₄₄N₈₁O₉₉P₁₉S₁₉

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(=S)(O)OC7CC(OC7COP(=S)(O)OC8CC(OC8COP(=S)(O)OC9CC(OC9COP(=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=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=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=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)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)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C195H244N81O99P19S19/c1-72-34-262(193(296)254-167(72)279)120-14-75(278)96(338-120)38-318-376(299,395)365-84-23-128(265-60-219-140-152(201)213-57-216-155(140)265)346-104(84)46-326-388(311,407)371-91-30-136(273-68-227-148-163(273)241-184(209)250-175(148)287)354-112(91)54-334-393(316,412)373-92-31-137(274-69-228-149-164(274)242-185(210)251-176(149)288)352-110(92)52-332-387(310,406)367-86-25-130(267-62-221-142-154(203)215-59-218-157(142)267)348-106(86)48-328-390(313,409)370-89-28-134(271-66-225-146-161(271)239-182(207)248-173(146)285)350-108(89)50-330-382(305,401)362-81-20-125(261-13-8-119(200)235-192(261)295)343-101(81)43-324-386(309,405)368-87-26-132(269-64-223-144-159(269)237-180(205)246-171(144)283)353-111(87)53-333-392(315,411)374-93-32-138(275-70-229-150-165(275)243-186(211)252-177(150)289)356-114(93)56-336-394(317,413)375-94-33-139(276-71-230-151-166(276)244-187(212)253-178(151)290)355-113(94)55-335-391(314,410)372-90-29-135(272-67-226-147-162(272)240-183(208)249-174(147)286)351-109(90)51-331-384(307,403)364-83-22-127(264-36-74(3)169(281)256-195(264)298)345-103(83)45-325-380(303,399)360-79-18-123(259-11-6-117(198)233-190(259)293)342-100(79)42-323-385(308,404)366-85-24-129(266-61-220-141-153(202)214-58-217-156(141)266)347-105(85)47-327-389(312,408)369-88-27-133(270-65-224-145-160(270)238-181(206)247-172(145)284)349-107(88)49-329-381(304,400)361-80-19-124(260-12-7-118(199)234-191(260)294)340-98(80)40-321-378(301,397)358-77-16-121(257-9-4-115(196)231-188(257)291)339-97(77)39-320-379(302,398)359-78-17-122(258-10-5-116(197)232-189(258)292)341-99(78)41-322-383(306,402)363-82-21-126(263-35-73(2)168(280)255-194(263)297)344-102(82)44-319-377(300,396)357-76-15-131(337-95(76)37-277)268-63-222-143-158(268)236-179(204)245-170(143)282/h4-13,34-36,57-71,75-114,120-139,277-278H,14-33,37-56H2,1-3H3,(H,299,395)(H,300,396)(H,301,397)(H,302,398)(H,303,399)(H,304,400)(H,305,401)(H,306,402)(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)(H2,196,231,291)(H2,197,232,292)(H2,198,233,293)(H2,199,234,294)(H2,200,235,295)(H2,201,213,216)(H2,202,214,217)(H2,203,215,218)(H,254,279,296)(H,255,280,297)(H,256,281,298)(H3,204,236,245,282)(H3,205,237,246,283)(H3,206,238,247,284)(H3,207,239,248,285)(H3,208,240,249,286)(H3,209,241,250,287)(H3,210,242,251,288)(H3,211,243,252,289)(H3,212,244,253,290)

InChIKey

HUXWEUAOTGACCI-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-[[[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-[[[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-(hydroxymethyl)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-(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-(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]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]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16133536