Hiv-1 12-mer tar rna containing 2'-o-methyl and 2',4'-locked nucleotides: 5'-[2'-ome(c')-2'-ome(u)-2'-ome(c)-2'-ome(c)-2'-ome(g)-lna(c)-2'-ome(a)-2'-ome(g)-lna(c)-2'-ome(u)-lna(c)-2'-ome(a)-l-homoserine-6-carboxyfluorescein]

Structural Information

Molecular Formula

C₁₅₄H₁₉₀N₄₄O₉₂P₁₂

SMILES

CC1=CN(C(=O)N=C1N)C2C3C(C(O2)(CO3)COP(=O)(O)OC4C(OC(C4OC)N5C=NC6=C5N=C(NC6=O)N)COP(=O)(O)OC7C(OC(C7OC)N8C=NC9=C(N=CN=C98)N)COP(=O)(O)OC1C2C(OC1(CO2)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=NC1=O)N)C)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=O)NC1=O)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=NC1=O)N)C)CO)N1C=C(C(=NC1=O)N)C)OP(=O)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)OC)OP(=O)(O)OCC12COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C(N=CN=C31)N)OC)OP(=O)(O)OCC[C@@H](C(=O)N)NC(=O)C1=CC3=C(C=C1)C(=O)OC31C3=C(C=C(C=C3)O)OC3=C1C=CC(=C3)O)C(O2)N1C=C(C(=NC1=O)N)C

InChI

InChI=1S/C154H190N44O92P12/c1-58-32-190(146(212)178-113(58)156)131-98(241-6)89(73(37-199)266-131)279-292(219,220)254-38-75-91(100(243-8)129(268-75)188-26-22-83(202)176-144(188)210)282-293(221,222)256-40-77-93(102(245-10)132(270-77)191-33-59(2)114(157)179-147(191)213)283-295(225,226)255-39-74-90(99(242-7)128(267-74)187-25-21-82(155)175-143(187)209)281-294(223,224)257-41-78-96(105(248-13)135(273-78)197-56-172-87-123(197)183-141(164)185-126(87)206)286-301(237,238)264-51-153-48-252-109(139(277-153)194-36-62(5)117(160)182-150(194)216)112(153)290-299(233,234)261-45-81-95(104(247-12)134(272-81)196-55-171-86-119(162)167-53-169-122(86)196)284-296(227,228)258-42-79-97(106(249-14)136(274-79)198-57-173-88-124(198)184-142(165)186-127(88)207)287-302(239,240)263-50-152-47-251-107(137(276-152)192-34-60(3)115(158)180-148(192)214)110(152)288-297(229,230)259-43-76-92(101(244-9)130(269-76)189-27-23-84(203)177-145(189)211)285-300(235,236)262-49-151-46-250-108(138(275-151)193-35-61(4)116(159)181-149(193)215)111(151)289-298(231,232)260-44-80-94(103(246-11)133(271-80)195-54-170-85-118(161)166-52-168-121(85)195)280-291(217,218)253-28-24-70(120(163)204)174-125(205)63-15-18-66-69(29-63)154(278-140(66)208)67-19-16-64(200)30-71(67)265-72-31-65(201)17-20-68(72)154/h15-23,25-27,29-36,52-57,70,73-81,89-112,128-139,199-201H,24,28,37-51H2,1-14H3,(H2,163,204)(H,174,205)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H2,155,175,209)(H2,156,178,212)(H2,157,179,213)(H2,158,180,214)(H2,159,181,215)(H2,160,182,216)(H2,161,166,168)(H2,162,167,169)(H,176,202,210)(H,177,203,211)(H3,164,183,185,206)(H3,165,184,186,207)/t70-,73?,74?,75?,76?,77?,78?,79?,80?,81?,89?,90?,91?,92?,93?,94?,95?,96?,97?,98?,99?,100?,101?,102?,103?,104?,105?,106?,107?,108?,109?,110?,111?,112?,128?,129?,130?,131?,132?,133?,134?,135?,136?,137?,138?,139?,151?,152?,153?/m0/s1

InChIKey

FDJYWZFNCYMEAG-LWDAAPTCSA-N

Compound name

[3-[[3-[[3-[[3-[[7-[[3-[[3-[[7-[[3-[[7-[[3-[[(3S)-4-amino-3-[(3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carbonyl)amino]-4-oxobutoxy]-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphoryl]oxy-5-(2-amino-6-oxo-1H-purin-9-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-hydroxyphosphoryl]oxy-5-(2-amino-6-oxo-1H-purin-9-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methyl [5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxyoxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16131955