S2(dc)14

Structural Information

Molecular Formula

C₁₂₆H₁₆₉N₄₂O₅₆P₁₃S₂₆

SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)COP(=S)(OC3CC(OC3COP(=S)(OC4CC(OC4COP(=S)(OC5CC(OC5COP(=S)(OC6CC(OC6COP(=S)(OC7CC(OC7COP(=S)(OC8CC(OC8COP(=S)(OC9CC(OC9COP(=S)(OC1CC(OC1COP(=S)(OC1CC(OC1COP(=S)(OC1CC(OC1COP(=S)(OC1CC(OC1COP(=S)(OC1CC(OC1COP(=S)(OC1CC(OC1CO)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)S)O

InChI

InChI=1S/C126H169N42O56P13S26/c127-85-1-15-155(113(171)141-85)99-29-57(170)72(199-99)44-185-225(238,239)213-59-31-101(157-17-3-87(129)143-115(157)173)201-74(59)46-187-227(242,243)215-61-33-103(159-19-5-89(131)145-117(159)175)203-76(61)48-189-229(246,247)217-63-35-105(161-21-7-91(133)147-119(161)177)205-78(63)50-191-231(250,251)219-65-37-107(163-23-9-93(135)149-121(163)179)207-80(65)52-193-233(254,255)221-67-39-109(165-25-11-95(137)151-123(165)181)209-82(67)54-195-235(258,259)223-69-41-111(167-27-13-97(139)153-125(167)183)211-84(69)56-197-237(262,263)224-70-42-112(168-28-14-98(140)154-126(168)184)210-83(70)55-196-236(260,261)222-68-40-110(166-26-12-96(138)152-124(166)182)208-81(68)53-194-234(256,257)220-66-38-108(164-24-10-94(136)150-122(164)180)206-79(66)51-192-232(252,253)218-64-36-106(162-22-8-92(134)148-120(162)178)204-77(64)49-190-230(248,249)216-62-34-104(160-20-6-90(132)146-118(160)176)202-75(62)47-188-228(244,245)214-60-32-102(158-18-4-88(130)144-116(158)174)200-73(60)45-186-226(240,241)212-58-30-100(198-71(58)43-169)156-16-2-86(128)142-114(156)172/h1-28,57-84,99-112,169-170H,29-56H2,(H,238,239)(H,240,241)(H,242,243)(H,244,245)(H,246,247)(H,248,249)(H,250,251)(H,252,253)(H,254,255)(H,256,257)(H,258,259)(H,260,261)(H,262,263)(H2,127,141,171)(H2,128,142,172)(H2,129,143,173)(H2,130,144,174)(H2,131,145,175)(H2,132,146,176)(H2,133,147,177)(H2,134,148,178)(H2,135,149,179)(H2,136,150,180)(H2,137,151,181)(H2,138,152,182)(H2,139,153,183)(H2,140,154,184)

InChIKey

IBEPZNNGGPZYHP-UHFFFAOYSA-N

Compound name

4-amino-1-[5-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphinothioyl]oxymethyl]-4-hydroxyoxolan-2-yl]pyrimidin-2-one

Related CIDs

• CID 16130158
• CID 16197308