CID 16130373
Rm-20 oligonucleotide group
Structural Information
- Molecular Formula
- C193H243N80O114P19
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1CO)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=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=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O
- InChI
- InChI=1S/C193H243N80O114P19/c1-76-37-261(192(290)252-173(76)276)133-26-87(377-396(308,309)333-44-103-82(21-128(354-103)256-12-5-120(196)237-187(256)285)371-390(296,297)332-43-102-84(23-130(353-102)258-14-7-122(198)239-189(258)287)374-393(302,303)342-52-111-92(31-138(362-111)267-69-228-149-160(205)216-63-222-166(149)267)382-404(324,325)347-57-116-97(36-144(367-116)273-75-234-155-172(273)246-184(211)251-179(155)282)387-406(328,329)348-58-117-96(35-143(368-117)272-74-233-154-171(272)245-183(210)250-178(154)281)384-398(312,313)335-42-101-80(19-126(352-101)254-10-3-118(194)235-185(254)283)370-388(292,293)330-40-99-78(275)17-125(350-99)263-65-224-145-156(201)212-59-218-162(145)263)107(358-133)48-338-391(298,299)372-83-22-129(257-13-6-121(197)238-188(257)286)356-105(83)46-336-399(314,315)385-94-33-141(270-72-231-152-169(270)243-181(208)248-176(152)279)365-114(94)55-345-403(322,323)381-91-30-137(266-68-227-148-159(204)215-62-221-165(148)266)363-112(91)53-343-395(306,307)376-86-25-132(260-16-9-124(200)241-191(260)289)357-106(86)47-337-400(316,317)386-95-34-142(271-73-232-153-170(271)244-182(209)249-177(153)280)366-115(95)56-346-405(326,327)383-93-32-139(268-70-229-150-161(206)217-64-223-167(150)268)364-113(93)54-344-402(320,321)380-90-29-136(265-67-226-147-158(203)214-61-220-164(147)265)361-110(90)51-341-394(304,305)375-85-24-131(259-15-8-123(199)240-190(259)288)355-104(85)45-334-397(310,311)378-88-27-134(262-38-77(2)174(277)253-193(262)291)359-108(88)49-339-401(318,319)379-89-28-135(264-66-225-146-157(202)213-60-219-163(146)264)360-109(89)50-340-392(300,301)373-81-20-127(255-11-4-119(195)236-186(255)284)351-100(81)41-331-389(294,295)369-79-18-140(349-98(79)39-274)269-71-230-151-168(269)242-180(207)247-175(151)278/h3-16,37-38,59-75,78-117,125-144,274-275H,17-36,39-58H2,1-2H3,(H,292,293)(H,294,295)(H,296,297)(H,298,299)(H,300,301)(H,302,303)(H,304,305)(H,306,307)(H,308,309)(H,310,311)(H,312,313)(H,314,315)(H,316,317)(H,318,319)(H,320,321)(H,322,323)(H,324,325)(H,326,327)(H,328,329)(H2,194,235,283)(H2,195,236,284)(H2,196,237,285)(H2,197,238,286)(H2,198,239,287)(H2,199,240,288)(H2,200,241,289)(H2,201,212,218)(H2,202,213,219)(H2,203,214,220)(H2,204,215,221)(H2,205,216,222)(H2,206,217,223)(H,252,276,290)(H,253,277,291)(H3,207,242,247,278)(H3,208,243,248,279)(H3,209,244,249,280)(H3,210,245,250,281)(H3,211,246,251,282)
- InChIKey
- MFMIWTOXXFNYGM-UHFFFAOYSA-N
- Compound name
- [5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6094.0766 | 311.5 |
[M+Na]+ | 6116.0585 | 311.5 |
[M-H]- | 6092.0620 | 311.5 |
[M+NH4]+ | 6111.1031 | 311.5 |
[M+K]+ | 6132.0325 | 311.5 |
[M+H-H2O]+ | 6076.0666 | 311.5 |
[M+HCOO]- | 6138.0675 | 311.5 |
[M+CH3COO]- | 6152.0832 | 311.5 |
[M+Na-2H]- | 6114.0440 | 311.5 |
[M]+ | 6093.0688 | 311.5 |
[M]- | 6093.0698 | 311.5 |
Literature stripe
Patent stripe
No patent data available for this compound.