Cagatgttgttgcgcctc

Structural Information

Molecular Formula

C₁₇₅H₂₂₄N₆₂O₁₁₃P₁₈

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)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C175H224N62O113P18/c1-68-35-225(170(255)214-149(68)239)120-22-79(338-352(264,265)299-41-92-74(238)17-115(316-92)220-12-7-110(176)199-165(220)250)97(321-120)46-303-355(270,271)336-77-20-118(223-15-10-113(179)202-168(223)253)318-94(77)43-300-354(268,269)335-76-19-117(222-14-9-112(178)201-167(222)252)319-95(76)44-301-362(284,285)346-87-30-128(233-63-194-135-144(233)204-160(183)209-155(135)245)329-105(87)54-311-356(272,273)337-78-21-119(224-16-11-114(180)203-169(224)254)320-96(78)45-302-363(286,287)347-88-31-129(234-64-195-136-145(234)205-161(184)210-156(136)246)330-106(88)55-312-359(278,279)341-82-25-123(228-38-71(4)152(242)217-173(228)258)322-98(82)47-304-357(274,275)339-80-23-121(226-36-69(2)150(240)215-171(226)256)325-101(80)50-307-365(290,291)348-89-32-130(235-65-196-137-146(235)206-162(185)211-157(137)247)331-107(89)56-313-360(280,281)342-83-26-124(229-39-72(5)153(243)218-174(229)259)323-99(83)48-305-358(276,277)340-81-24-122(227-37-70(3)151(241)216-172(227)257)326-102(81)51-308-366(292,293)349-90-33-131(236-66-197-138-147(236)207-163(186)212-158(138)248)332-108(90)57-314-361(282,283)343-84-27-125(230-40-73(6)154(244)219-175(230)260)324-100(84)49-306-364(288,289)344-85-28-126(231-61-192-133-140(181)188-59-190-142(133)231)328-104(85)53-310-368(296,297)350-91-34-132(237-67-198-139-148(237)208-164(187)213-159(139)249)333-109(91)58-315-367(294,295)345-86-29-127(232-62-193-134-141(182)189-60-191-143(134)232)327-103(86)52-309-353(266,267)334-75-18-116(221-13-8-111(177)200-166(221)251)317-93(75)42-298-351(261,262)263/h7-16,35-40,59-67,74-109,115-132,238H,17-34,41-58H2,1-6H3,(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)(H,296,297)(H2,176,199,250)(H2,177,200,251)(H2,178,201,252)(H2,179,202,253)(H2,180,203,254)(H2,181,188,190)(H2,182,189,191)(H,214,239,255)(H,215,240,256)(H,216,241,257)(H,217,242,258)(H,218,243,259)(H,219,244,260)(H2,261,262,263)(H3,183,204,209,245)(H3,184,205,210,246)(H3,185,206,211,247)(H3,186,207,212,248)(H3,187,208,213,249)

InChIKey

AVXUWEKVEKMVNK-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16197298