Gtcaatgacactgcgccc

Structural Information

Molecular Formula

C₁₇₃H₂₂₁N₆₇O₁₀₈P₁₈

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C173H221N67O108P18/c1-69-36-230(171(256)220-153(69)242)122-25-79(99(322-122)48-305-359(280,281)341-82-32-129(324-91(82)40-296-349(259,260)261)237-65-201-137-149(237)212-160(185)216-156(137)245)338-356(274,275)299-42-93-76(22-119(316-93)227-15-8-112(178)209-168(227)253)335-353(268,269)308-51-102-86(31-128(326-102)236-64-200-136-144(184)192-60-196-148(136)236)345-365(292,293)309-52-103-85(30-127(327-103)235-63-199-135-143(183)191-59-195-147(135)235)344-364(290,291)306-49-100-81(27-124(323-100)232-38-71(3)155(244)222-173(232)258)340-358(278,279)313-56-107-89(35-132(331-107)240-68-204-140-152(240)215-163(188)219-159(140)248)348-366(294,295)310-53-104-84(29-126(328-104)234-62-198-134-142(182)190-58-194-146(134)234)343-361(284,285)301-44-95-77(23-120(318-95)228-16-9-113(179)210-169(228)254)336-354(270,271)307-50-101-83(28-125(325-101)233-61-197-133-141(181)189-57-193-145(133)233)342-360(282,283)300-43-94-75(21-118(317-94)226-14-7-111(177)208-167(226)252)334-352(266,267)304-47-98-80(26-123(321-98)231-37-70(2)154(243)221-172(231)257)339-357(276,277)312-55-106-88(34-131(330-106)239-67-203-139-151(239)214-162(187)218-158(139)247)347-363(288,289)303-46-97-78(24-121(320-97)229-17-10-114(180)211-170(229)255)337-355(272,273)311-54-105-87(33-130(329-105)238-66-202-138-150(238)213-161(186)217-157(138)246)346-362(286,287)302-45-96-74(20-117(319-96)225-13-6-110(176)207-166(225)251)333-351(264,265)298-41-92-73(19-116(315-92)224-12-5-109(175)206-165(224)250)332-350(262,263)297-39-90-72(241)18-115(314-90)223-11-4-108(174)205-164(223)249/h4-17,36-38,57-68,72-107,115-132,241H,18-35,39-56H2,1-3H3,(H,262,263)(H,264,265)(H,266,267)(H,268,269)(H,270,271)(H,272,273)(H,274,275)(H,276,277)(H,278,279)(H,280,281)(H,282,283)(H,284,285)(H,286,287)(H,288,289)(H,290,291)(H,292,293)(H,294,295)(H2,174,205,249)(H2,175,206,250)(H2,176,207,251)(H2,177,208,252)(H2,178,209,253)(H2,179,210,254)(H2,180,211,255)(H2,181,189,193)(H2,182,190,194)(H2,183,191,195)(H2,184,192,196)(H,220,242,256)(H,221,243,257)(H,222,244,258)(H2,259,260,261)(H3,185,212,216,245)(H3,186,213,217,246)(H3,187,214,218,247)(H3,188,215,219,248)

InChIKey

ZPLNNWAGIZMAEH-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16197288