5'-dmtr-gaggtgggtctg-3'

Structural Information

Molecular Formula

C₁₄₀H₁₆₆N₄₉O₇₄P₁₁

SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O[C@H]3C[C@@H](O[C@@H]3COP(=O)(O)O[C@H]4C[C@@H](O[C@@H]4COP(=O)(O)O[C@H]5C[C@@H](O[C@@H]5COP(=O)(O)O[C@H]6C[C@@H](O[C@@H]6COP(=O)(O)O[C@H]7C[C@@H](O[C@@H]7COP(=O)(O)O[C@H]8C[C@@H](O[C@@H]8COP(=O)(O)O[C@H]9C[C@@H](O[C@@H]9COP(=O)(O)O[C@H]1C[C@@H](O[C@@H]1COP(=O)(O)O[C@H]1CC(O[C@@H]1COP(=O)(O)O[C@H]1C[C@@H](O[C@@H]1COC(C1=CC=CC=C1)(C1=CC=C(C=C1)OC)C1=CC=C(C=C1)OC)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=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)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C140H166N49O74P11/c1-57-33-179(137(202)175-119(57)191)92-23-68(255-264(205,206)230-37-77-65(190)21-90(241-77)183-50-153-103-112(183)161-129(143)168-122(103)194)80(244-92)39-232-266(209,210)254-67-22-91(178-20-19-89(141)160-136(178)201)243-79(67)38-231-267(211,212)256-69-24-93(180-34-58(2)120(192)176-138(180)203)245-81(69)40-233-269(215,216)259-72-28-97(185-52-155-105-114(185)163-131(145)170-124(105)196)251-87(72)46-239-274(225,226)263-76-32-101(189-56-159-109-118(189)167-135(149)174-128(109)200)252-88(76)47-240-272(221,222)261-74-30-99(187-54-157-107-116(187)165-133(147)172-126(107)198)248-84(74)43-236-268(213,214)257-70-25-94(181-35-59(3)121(193)177-139(181)204)246-82(70)41-234-270(217,218)260-73-29-98(186-53-156-106-115(186)164-132(146)171-125(106)197)250-86(73)45-238-273(223,224)262-75-31-100(188-55-158-108-117(188)166-134(148)173-127(108)199)249-85(75)44-237-271(219,220)258-71-27-95(182-49-152-102-110(142)150-48-151-111(102)182)247-83(71)42-235-265(207,208)253-66-26-96(184-51-154-104-113(184)162-130(144)169-123(104)195)242-78(66)36-229-140(60-9-7-6-8-10-60,61-11-15-63(227-4)16-12-61)62-13-17-64(228-5)18-14-62/h6-20,33-35,48-56,65-88,90-101,190H,21-32,36-47H2,1-5H3,(H,205,206)(H,207,208)(H,209,210)(H,211,212)(H,213,214)(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H2,141,160,201)(H2,142,150,151)(H,175,191,202)(H,176,192,203)(H,177,193,204)(H3,143,161,168,194)(H3,144,162,169,195)(H3,145,163,170,196)(H3,146,164,171,197)(H3,147,165,172,198)(H3,148,166,173,199)(H3,149,167,174,200)/t65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77+,78+,79+,80+,81+,82+,83+,84+,85+,86+,87+,88+,90+,91+,92+,93+,94+,95?,96+,97+,98+,99+,100+,101+/m0/s1

InChIKey

PCMBTZRTHBQOJA-SLPUMMQFSA-N

Compound name

[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[(2R,3S,5R)-2-[[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[(2R,3S)-2-[[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-3-[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16186516