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

Structural Information

Molecular Formula

C₁₅₄H₁₈₆N₄₄O₉₂P₁₂

SMILES

CC1=CN(C(=O)N=C1N)C2C3C(C(O2)(CO3)CO)OP(=O)(O)OCC4C(C(C(O4)N5C=CC(=O)NC5=O)OC)OP(=O)(O)OCC67COC(C6OP(=O)(O)OCC8C(C(C(O8)N9C=CC(=NC9=O)N)OC)OP(=O)(O)OCC12COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C(N=CN=C31)N)OC)OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C1N=C(NC3=O)N)OC)OP(=O)(O)OCC1C(C(C(O1)N1C=NC3=C1N=C(NC3=O)N)OC)OP(=O)(O)OCC13COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)OC)OP(=O)(O)OCC14COC(C1OP(=O)(O)OCC1C(C(C(O1)N1C=NC5=C(N=CN=C51)N)OC)OP(=O)(O)OCC[C@@H](C(=O)N)NC(=O)C1=CC5=C(C=C1)C(=O)OC51C5=C(C=C(C=C5)O)OC5=C1C=CC(=C5)O)C(O4)N1C=C(C(=NC1=O)N)C)C(O3)N1C=C(C(=NC1=O)N)C)C(O2)N1C=C(C(=NC1=O)N)C)C(O7)N1C=C(C(=NC1=O)N)C

InChI

InChI=1S/C154H186N44O92P12/c1-58-30-190(144(212)178-111(58)156)133-101-106(149(42-199,273-133)43-248-101)286-294(223,224)256-37-74-88(95(242-7)127(267-74)188-24-20-81(202)176-142(188)210)283-300(235,236)262-49-150-44-249-102(134(274-150)191-31-59(2)112(157)179-145(191)213)107(150)287-295(225,226)257-38-73-87(94(241-6)126(266-73)187-23-19-80(155)175-141(187)209)282-299(233,234)261-48-151-45-251-105(137(275-151)194-34-62(5)115(160)182-148(194)216)110(151)290-298(231,232)260-41-79-91(98(245-10)130(270-79)196-55-171-84-117(162)167-53-169-120(84)196)280-292(219,220)254-35-76-92(99(246-11)131(271-76)197-56-172-85-121(197)183-139(164)185-124(85)206)281-293(221,222)255-36-77-93(100(247-12)132(272-77)198-57-173-86-122(198)184-140(165)186-125(86)207)285-302(239,240)264-51-153-47-252-103(135(277-153)192-32-60(3)113(158)180-146(192)214)108(153)288-296(227,228)258-39-75-89(96(243-8)128(268-75)189-25-21-82(203)177-143(189)211)284-301(237,238)263-50-152-46-250-104(136(276-152)193-33-61(4)114(159)181-147(193)215)109(152)289-297(229,230)259-40-78-90(97(244-9)129(269-78)195-54-170-83-116(161)166-52-168-119(83)195)279-291(217,218)253-26-22-70(118(163)204)174-123(205)63-13-16-66-69(27-63)154(278-138(66)208)67-17-14-64(200)28-71(67)265-72-29-65(201)15-18-68(72)154/h13-21,23-25,27-34,52-57,70,73-79,87-110,126-137,199-201H,22,26,35-51H2,1-12H3,(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?,87?,88?,89?,90?,91?,92?,93?,94?,95?,96?,97?,98?,99?,100?,101?,102?,103?,104?,105?,106?,107?,108?,109?,110?,126?,127?,128?,129?,130?,131?,132?,133?,134?,135?,136?,137?,149?,150?,151?,152?,153?/m0/s1

InChIKey

CVQOLECEWGCPIL-FGTGYIQRSA-N

Compound name

[3-[[7-[[3-[[7-[[3-[[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-(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-(4-amino-2-oxopyrimidin-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-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methyl [3-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] hydrogen phosphate

Related CIDs

• CID 16131947