(3-5)-octadecylamine conjugated oligonucleotide(ptgcctggagctgcttgatgc)

Structural Information

Molecular Formula

C₂₁₃H₂₈₅N₇₃O₁₂₄P₂₀

SMILES

CCCCCCCCCCCCCCCCCCNP(=O)(O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)OP(=O)(O)OCC3C(CC(O3)N4C=NC5=C4N=C(NC5=O)N)OP(=O)(O)OCC6C(CC(O6)N7C=CC(=NC7=O)N)OP(=O)(O)OCC8C(CC(O8)N9C=CC(=NC9=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C213H285N73O124P20/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-29-241-411(312,313)352-62-119-103(40-148(377-119)272-55-92(2)183(288)261-208(272)306)396-417(324,325)365-75-132-112(49-157(386-132)281-86-235-166-177(281)248-197(222)255-190(166)295)405-423(336,337)355-64-121-99(36-144(374-121)268-31-25-139(215)243-204(268)302)392-413(316,317)354-63-120-100(37-145(373-120)269-32-26-140(216)244-205(269)303)393-414(318,319)359-68-125-106(43-151(379-125)275-58-95(5)186(291)264-211(275)309)399-421(332,333)369-78-135-116(53-161(389-135)285-90-239-170-181(285)252-201(226)259-194(170)299)410-430(350,351)371-80-137-117(54-162(391-137)286-91-240-171-182(286)253-202(227)260-195(171)300)409-429(348,349)364-73-130-110(47-155(384-130)279-84-233-164-173(220)229-82-231-175(164)279)404-427(344,345)370-79-136-114(51-159(390-136)283-88-237-168-179(283)250-199(224)257-192(168)297)407-425(340,341)357-66-123-102(39-147(376-123)271-34-28-142(218)246-207(271)305)395-416(322,323)360-69-126-105(42-150(380-126)274-57-94(4)185(290)263-210(274)308)398-420(330,331)367-76-133-113(50-158(387-133)282-87-236-167-178(282)249-198(223)256-191(167)296)406-424(338,339)356-65-122-101(38-146(375-122)270-33-27-141(217)245-206(270)304)394-415(320,321)358-67-124-104(41-149(378-124)273-56-93(3)184(289)262-209(273)307)397-418(326,327)361-70-127-107(44-152(381-127)276-59-96(6)187(292)265-212(276)310)400-422(334,335)368-77-134-115(52-160(388-134)284-89-238-169-180(284)251-200(225)258-193(169)298)408-428(346,347)363-72-129-109(46-154(383-129)278-83-232-163-172(219)228-81-230-174(163)278)403-426(342,343)362-71-128-108(45-153(382-128)277-60-97(7)188(293)266-213(277)311)401-419(328,329)366-74-131-111(48-156(385-131)280-85-234-165-176(280)247-196(221)254-189(165)294)402-412(314,315)353-61-118-98(287)35-143(372-118)267-30-24-138(214)242-203(267)301/h24-28,30-34,55-60,81-91,98-137,143-162,287H,8-23,29,35-54,61-80H2,1-7H3,(H,314,315)(H,316,317)(H,318,319)(H,320,321)(H,322,323)(H,324,325)(H,326,327)(H,328,329)(H,330,331)(H,332,333)(H,334,335)(H,336,337)(H,338,339)(H,340,341)(H,342,343)(H,344,345)(H,346,347)(H,348,349)(H,350,351)(H2,214,242,301)(H2,215,243,302)(H2,216,244,303)(H2,217,245,304)(H2,218,246,305)(H2,219,228,230)(H2,220,229,231)(H2,241,312,313)(H,261,288,306)(H,262,289,307)(H,263,290,308)(H,264,291,309)(H,265,292,310)(H,266,293,311)(H3,221,247,254,294)(H3,222,248,255,295)(H3,223,249,256,296)(H3,224,250,257,297)(H3,225,251,258,298)(H3,226,252,259,299)(H3,227,253,260,300)

InChIKey

YVXRSIKCCBPZAH-UHFFFAOYSA-N

Compound name

[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-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-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-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-(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]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-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-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-(4-amino-2-oxopyrimidin-1-yl)oxolan-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-N-octadecylphosphonamidic acid

Related CIDs

• CID 16130141