Mismatched as(lys) (101)

Structural Information

Molecular Formula

C₁₅₃H₁₉₆N₅₇O₇₉P₁₅S₁₄

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5CO)N6C=CC(=NC6=O)N)N7C=CC(=NC7=O)N)N8C=CC(=NC8=O)N)OP(=S)(O)OCC9C(CC(O9)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C153H196N57O79P15S14/c1-63-34-202(151(225)192-137(63)213)113-26-74(92(268-113)47-253-299(238,313)283-75-27-114(203-35-64(2)138(214)193-152(203)226)269-93(75)48-254-302(241,316)289-81-33-120(210-62-180-126-136(210)189-143(166)191-141(126)217)274-97(81)52-258-300(239,314)284-76-28-115(204-36-65(3)139(215)194-153(204)227)267-91(76)46-252-296(235,310)280-72-24-111(200-16-9-103(159)186-149(200)223)264-88(72)43-249-295(234,309)278-70-22-109(198-14-7-101(157)184-147(198)221)262-86(70)41-247-292(231,306)276-67-19-106(259-82(67)37-211)195-11-4-98(154)181-144(195)218)282-298(237,312)250-44-89-73(25-112(265-89)201-17-10-104(160)187-150(201)224)281-297(236,311)255-49-94-79(30-117(271-94)207-59-177-123-129(163)169-55-173-133(123)207)287-304(243,318)257-51-96-80(31-118(273-96)208-60-178-124-130(164)170-56-174-134(124)208)288-303(242,317)256-50-95-78(29-116(272-95)206-58-176-122-128(162)168-54-172-132(122)206)286-293(232,307)246-40-85-68(20-107(261-85)196-12-5-99(155)182-145(196)219)275-290(228,229)244-39-84-77(32-119(270-84)209-61-179-125-135(209)188-142(165)190-140(125)216)285-301(240,315)251-45-90-71(23-110(266-90)199-15-8-102(158)185-148(199)222)279-294(233,308)248-42-87-69(21-108(263-87)197-13-6-100(156)183-146(197)220)277-291(230,305)245-38-83-66(212)18-105(260-83)205-57-175-121-127(161)167-53-171-131(121)205/h4-17,34-36,53-62,66-97,105-120,211-212H,18-33,37-52H2,1-3H3,(H,228,229)(H,230,305)(H,231,306)(H,232,307)(H,233,308)(H,234,309)(H,235,310)(H,236,311)(H,237,312)(H,238,313)(H,239,314)(H,240,315)(H,241,316)(H,242,317)(H,243,318)(H2,154,181,218)(H2,155,182,219)(H2,156,183,220)(H2,157,184,221)(H2,158,185,222)(H2,159,186,223)(H2,160,187,224)(H2,161,167,171)(H2,162,168,172)(H2,163,169,173)(H2,164,170,174)(H,192,213,225)(H,193,214,226)(H,194,215,227)(H3,165,188,190,216)(H3,166,189,191,217)

InChIKey

RUJRTYWXMASTMV-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16133938