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

Structural Information

Molecular Formula

C₁₄₆H₁₈₃N₆₁O₇₃P₁₄S₁₄

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(OC1CO)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=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=C1N=C(NC2=O)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C146H183N61O73P14S14/c1-55-26-197(145(222)191-127(55)210)91-11-57(209)73(253-91)29-238-281(224,295)273-67-21-101(203-50-170-110-122(203)180-136(155)186-130(110)213)262-82(67)38-247-286(229,300)271-62-16-95(196-10-6-90(150)178-144(196)221)256-76(62)32-241-284(227,298)269-60-14-93(194-8-4-88(148)176-142(194)219)257-77(60)33-242-287(230,301)272-63-17-96(198-27-56(2)128(211)192-146(198)223)258-78(63)34-243-288(231,302)274-64-18-97(199-46-166-106-115(151)160-43-163-118(106)199)260-80(64)36-245-289(232,303)275-66-20-99(201-48-168-108-117(153)162-45-165-120(108)201)261-81(66)37-246-291(234,305)277-68-22-102(204-51-171-111-123(204)181-137(156)187-131(111)214)264-84(68)40-249-293(236,307)279-70-24-104(206-53-173-113-125(206)183-139(158)189-133(113)216)266-86(70)42-251-294(237,308)280-71-25-105(207-54-174-114-126(207)184-140(159)190-134(114)217)265-85(71)41-250-292(235,306)278-69-23-103(205-52-172-112-124(205)182-138(157)188-132(112)215)263-83(69)39-248-290(233,304)276-65-19-98(200-47-167-107-116(152)161-44-164-119(107)200)259-79(65)35-244-285(228,299)270-61-15-94(195-9-5-89(149)177-143(195)220)255-75(61)31-240-283(226,297)268-59-13-92(193-7-3-87(147)175-141(193)218)254-74(59)30-239-282(225,296)267-58-12-100(252-72(58)28-208)202-49-169-109-121(202)179-135(154)185-129(109)212/h3-10,26-27,43-54,57-86,91-105,208-209H,11-25,28-42H2,1-2H3,(H,224,295)(H,225,296)(H,226,297)(H,227,298)(H,228,299)(H,229,300)(H,230,301)(H,231,302)(H,232,303)(H,233,304)(H,234,305)(H,235,306)(H,236,307)(H,237,308)(H2,147,175,218)(H2,148,176,219)(H2,149,177,220)(H2,150,178,221)(H2,151,160,163)(H2,152,161,164)(H2,153,162,165)(H,191,210,222)(H,192,211,223)(H3,154,179,185,212)(H3,155,180,186,213)(H3,156,181,187,214)(H3,157,182,188,215)(H3,158,183,189,216)(H3,159,184,190,217)

InChIKey

DGMHQWFVNKYTGL-UHFFFAOYSA-N

Compound name

1-[5-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[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-(hydroxymethyl)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-(6-aminopurin-9-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-(6-aminopurin-9-yl)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]-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]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16133548