Tgctgttgcactatacca

Structural Information

Molecular Formula

C₁₇₅H₂₂₄N₆₂O₁₁₁P₁₈

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)O)OP(=O)(O)OCC3C(CC(O3)N4C=NC5=C4N=C(NC5=O)N)OP(=O)(O)OCC6C(CC(O6)N7C=CC(=NC7=O)N)OP(=O)(O)OCC8C(CC(O8)N9C=C(C(=O)NC9=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)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=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)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=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C175H224N62O111P18/c1-70-35-225(170(253)214-153(70)239)123-23-82(95(320-123)42-296-349(259,260)261)337-355(272,273)311-56-109-91(32-132(329-109)235-67-200-139-150(235)208-162(185)211-159(139)245)346-363(288,289)301-46-99-80(21-121(318-99)223-15-10-115(179)206-168(223)251)335-353(268,269)304-49-102-85(26-126(322-102)228-38-73(4)156(242)217-173(228)256)341-359(280,281)313-58-111-93(34-134(331-111)237-69-202-141-152(237)210-164(187)213-161(141)247)348-366(294,295)307-52-105-83(24-124(325-105)226-36-71(2)154(240)215-171(226)254)338-356(274,275)305-50-103-86(27-127(323-103)229-39-74(5)157(243)218-174(229)257)342-360(282,283)312-57-110-92(33-133(330-110)236-68-201-140-151(236)209-163(186)212-160(140)246)347-364(290,291)302-47-100-81(22-122(319-100)224-16-11-116(180)207-169(224)252)336-354(270,271)308-53-106-88(29-129(326-106)232-64-197-136-143(182)189-60-193-147(136)232)343-361(284,285)300-45-98-79(20-120(317-98)222-14-9-114(178)205-167(222)250)334-352(266,267)303-48-101-84(25-125(321-101)227-37-72(3)155(241)216-172(227)255)339-357(276,277)310-55-108-90(31-131(328-108)234-66-199-138-145(184)191-62-195-149(138)234)345-365(292,293)306-51-104-87(28-128(324-104)230-40-75(6)158(244)219-175(230)258)340-358(278,279)309-54-107-89(30-130(327-107)233-65-198-137-144(183)190-61-194-148(137)233)344-362(286,287)299-44-97-78(19-119(316-97)221-13-8-113(177)204-166(221)249)333-351(264,265)298-43-96-77(18-118(315-96)220-12-7-112(176)203-165(220)248)332-350(262,263)297-41-94-76(238)17-117(314-94)231-63-196-135-142(181)188-59-192-146(135)231/h7-16,35-40,59-69,76-111,117-134,238H,17-34,41-58H2,1-6H3,(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)(H2,176,203,248)(H2,177,204,249)(H2,178,205,250)(H2,179,206,251)(H2,180,207,252)(H2,181,188,192)(H2,182,189,193)(H2,183,190,194)(H2,184,191,195)(H,214,239,253)(H,215,240,254)(H,216,241,255)(H,217,242,256)(H,218,243,257)(H,219,244,258)(H2,259,260,261)(H3,185,208,211,245)(H3,186,209,212,246)(H3,187,210,213,247)

InChIKey

JBRSUSHZYGYDCG-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16197296