5'-dmtr-cctcggggttgggag-3'

Structural Information

Molecular Formula

C₁₆₈H₂₀₂N₆₀O₉₂P₁₄

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]4COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)N8C=CC(=NC8=O)N)N9C=CC(=NC9=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)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)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](CC(O1)N1C=NC2=C(N=CN=C21)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/C168H202N60O92P14/c1-68-40-217(165(244)211-143(68)230)113-29-80(95(296-113)47-281-323(251,252)308-78-27-111(215-23-20-107(170)193-163(215)242)294-93(78)45-279-322(249,250)307-77-26-110(214-22-19-106(169)192-162(214)241)293-92(77)43-277-168(71-9-7-6-8-10-71,72-11-15-74(275-4)16-12-72)73-13-17-75(276-5)18-14-73)310-325(255,256)280-46-94-79(28-112(295-94)216-24-21-108(171)194-164(216)243)309-324(253,254)285-51-99-85(34-118(300-99)223-62-186-127-137(223)197-156(175)205-148(127)235)316-330(265,266)289-55-103-89(38-122(304-103)227-66-190-131-141(227)201-160(179)209-152(131)239)320-334(273,274)291-57-105-88(37-121(306-105)226-65-189-130-140(226)200-159(178)208-151(130)238)318-332(269,270)287-53-101-84(33-117(302-101)222-61-185-126-136(222)196-155(174)204-147(126)234)314-328(261,262)283-49-97-81(30-114(298-97)218-41-69(2)144(231)212-166(218)245)311-326(257,258)282-48-96-82(31-115(297-96)219-42-70(3)145(232)213-167(219)246)312-327(259,260)286-52-100-86(35-119(301-100)224-63-187-128-138(224)198-157(176)206-149(128)236)317-331(267,268)290-56-104-90(39-123(305-104)228-67-191-132-142(228)202-161(180)210-153(132)240)319-333(271,272)288-54-102-87(36-120(303-102)225-64-188-129-139(225)199-158(177)207-150(129)237)315-329(263,264)284-50-98-83(32-116(299-98)220-59-183-124-133(172)181-58-182-134(124)220)313-321(247,248)278-44-91-76(229)25-109(292-91)221-60-184-125-135(221)195-154(173)203-146(125)233/h6-24,40-42,58-67,76-105,109-123,229H,25-39,43-57H2,1-5H3,(H,247,248)(H,249,250)(H,251,252)(H,253,254)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H2,169,192,241)(H2,170,193,242)(H2,171,194,243)(H2,172,181,182)(H,211,230,244)(H,212,231,245)(H,213,232,246)(H3,173,195,203,233)(H3,174,196,204,234)(H3,175,197,205,235)(H3,176,198,206,236)(H3,177,199,207,237)(H3,178,200,208,238)(H3,179,201,209,239)(H3,180,202,210,240)/t76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91+,92+,93+,94+,95+,96+,97+,98+,99+,100+,101+,102+,103+,104+,105+,109+,110+,111+,112+,113+,114+,115+,116?,117+,118+,119+,120+,121+,122+,123+/m0/s1

InChIKey

YZIIEPVKWKWVDI-HCRGTYJOSA-N

Compound name

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

Related CIDs

• CID 16186524