Oligo b 5'-thiol

Structural Information

Molecular Formula

C₁₅₆H₁₈₉N₄₂O₈₈P₁₁S

SMILES

CC1=CN(C(=O)N=C1N)C2C3C(C(O2)(CO3)COCCCCCCS)OP(=O)(O)OCC4C(C(C(O4)N5C=CC(=O)NC5=O)OC)OP(=O)(O)OCC67COC(C6OP(=O)(O)OCC8C(C(C(O8)N9C=CC(=NC9=O)N)OC)OP(=O)(O)OCC12COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C(N=CN=C31)N)OC)OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C1N=C(NC3=O)N)OC)OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C1N=C(NC3=O)N)OC)OP(=O)(O)OCC13COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)OC)OP(=O)(O)OCC14COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=NC5=C(N=CN=C51)N)OC)OC(=O)C1=CC5=C(C=C1)C(=O)OC51C5=C(C=C(C=C5)O)OC5=C1C=CC(=C5)O)C(O4)N1C=C(C(=NC1=O)N)C)C(O3)N1C=C(C(=NC1=O)N)C)C(O2)N1C=C(C(=NC1=O)N)C)C(O7)N1C=C(C(=NC1=O)N)C

InChI

InChI=1S/C156H189N42O88P11S/c1-62-34-190(146(210)178-114(62)158)134-104-109(151(270-134,47-245-104)46-244-29-15-13-14-16-30-298)282-290(221,222)253-43-78-92(99(239-8)128(264-78)188-27-24-84(201)176-144(188)208)279-296(233,234)259-54-153-49-247-106(136(272-153)192-36-64(3)116(160)180-148(192)212)111(153)284-291(223,224)254-42-77-91(98(238-7)127(263-77)187-26-23-83(157)175-143(187)207)278-294(229,230)257-53-154-50-248-108(138(273-154)194-38-66(5)118(162)182-150(194)214)113(154)286-293(227,228)256-45-82-94(101(241-10)131(266-82)196-59-172-87-120(164)168-57-170-122(87)196)276-287(215,216)250-40-80-95(102(242-11)132(267-80)197-60-173-88-123(197)183-141(165)185-125(88)203)277-288(217,218)251-41-81-96(103(243-12)133(268-81)198-61-174-89-124(198)184-142(166)186-126(89)204)281-297(235,236)260-55-155-51-249-107(137(274-155)193-37-65(4)117(161)181-149(193)213)112(155)285-292(225,226)255-44-79-93(100(240-9)129(265-79)189-28-25-85(202)177-145(189)209)280-295(231,232)258-52-152-48-246-105(135(271-152)191-35-63(2)115(159)179-147(191)211)110(152)283-289(219,220)252-39-76-90(97(237-6)130(262-76)195-58-171-86-119(163)167-56-169-121(86)195)269-139(205)67-17-20-70-73(31-67)156(275-140(70)206)71-21-18-68(199)32-74(71)261-75-33-69(200)19-22-72(75)156/h17-28,31-38,56-61,76-82,90-113,127-138,199-200,298H,13-16,29-30,39-55H2,1-12H3,(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H2,157,175,207)(H2,158,178,210)(H2,159,179,211)(H2,160,180,212)(H2,161,181,213)(H2,162,182,214)(H2,163,167,169)(H2,164,168,170)(H,176,201,208)(H,177,202,209)(H3,165,183,185,203)(H3,166,184,186,204)

InChIKey

IMGVZJIIPGKPHM-UHFFFAOYSA-N

Compound name

[2-[[[3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-[[[2-[[[3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-[[[2-[[[2-[[[2-[[[3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-[[[2-[[[3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-[[[2-[[[3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-(6-sulfanylhexoxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2-amino-6-oxo-1H-purin-9-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2-amino-6-oxo-1H-purin-9-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-methoxyoxolan-3-yl] 3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylate

Related CIDs

• CID 16197780