Oligo c 5'-thiol

Structural Information

Molecular Formula

C₁₇₇H₂₁₂N₅₇O₁₀₁P₁₅S₁₆

SMILES

C1=CC2=C(C=C1C(=O)OC3C(OC(C3O)N4C=CC(=NC4=O)N)COP(=S)(O)OC5C(OC(C5O)N6C=CC(=O)NC6=O)COP(=O)(OC7C(OC(C7O)N8C=NC9=C(N=CN=C98)N)COP(=S)(O)OC1C(OC(C1O)N1C=NC3=C1N=C(NC3=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=NC3=C(N=CN=C31)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=O)NC1=O)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=NC3=C1N=C(NC3=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=NC3=C1N=C(NC3=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=NC3=C(N=CN=C31)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=O)NC1=O)COP(=S)(O)OC1C(OC(C1O)N1C=CC(=NC1=O)N)COCCCCCCS)S)C1(C3=C(C=C(C=C3)O)OC3=C1C=CC(=C3)O)OC2=O

InChI

InChI=1S/C177H212N57O101P15S16/c178-86-11-21-219(167(261)203-86)146-102(240)118(319-162(259)61-5-8-64-67(33-61)177(320-163(64)260)65-9-6-62(235)34-68(65)302-69-35-63(236)7-10-66(69)177)71(304-146)37-287-336(271,352)322-125-78(311-153(109(125)247)226-28-18-93(237)210-174(226)268)45-295-345(280,361)330-128-82(315-156(112(128)250)229-55-197-96-134(185)191-52-194-137(96)229)48-298-349(284,365)334-132-83(316-160(116(132)254)233-59-201-100-141(233)214-165(189)217-144(100)257)49-299-347(282,363)331-129-81(314-157(113(129)251)230-56-198-97-135(186)192-53-195-138(97)230)47-297-344(279,360)327-124-75(308-152(108(124)246)225-27-17-92(184)209-173(225)267)41-292-342(277,358)329-127-79(312-155(111(127)249)228-30-20-95(239)212-176(228)270)44-293-340(275,356)325-122-76(309-150(106(122)244)223-25-15-90(182)207-171(223)265)42-294-346(281,362)333-131-85(318-159(115(131)253)232-58-200-99-140(232)213-164(188)216-143(99)256)51-301-350(285,366)335-133-84(317-161(117(133)255)234-60-202-101-142(234)215-166(190)218-145(101)258)50-300-348(283,364)332-130-80(313-158(114(130)252)231-57-199-98-136(187)193-54-196-139(98)231)46-296-343(278,359)326-123-74(307-151(107(123)245)224-26-16-91(183)208-172(224)266)39-290-339(274,355)323-120-72(305-148(104(120)242)221-23-13-88(180)205-169(221)263)38-289-338(273,354)324-121-73(306-149(105(121)243)222-24-14-89(181)206-170(222)264)40-291-341(276,357)328-126-77(310-154(110(126)248)227-29-19-94(238)211-175(227)269)43-288-337(272,353)321-119-70(36-286-31-3-1-2-4-32-351)303-147(103(119)241)220-22-12-87(179)204-168(220)262/h5-30,33-35,52-60,70-85,102-133,146-161,235-236,240-255,351H,1-4,31-32,36-51H2,(H,271,352)(H,272,353)(H,273,354)(H,274,355)(H,275,356)(H,276,357)(H,277,358)(H,278,359)(H,279,360)(H,280,361)(H,281,362)(H,282,363)(H,283,364)(H,284,365)(H,285,366)(H2,178,203,261)(H2,179,204,262)(H2,180,205,263)(H2,181,206,264)(H2,182,207,265)(H2,183,208,266)(H2,184,209,267)(H2,185,191,194)(H2,186,192,195)(H2,187,193,196)(H,210,237,268)(H,211,238,269)(H,212,239,270)(H3,188,213,216,256)(H3,189,214,217,257)(H3,190,215,218,258)

InChIKey

VDYXNKKHDLJEPV-UHFFFAOYSA-N

Compound name

[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-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(6-sulfanylhexoxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-sulfanylphosphoryl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl] 3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylate

Related CIDs

• CID 16204887