CID 16204623
5'-tcctccttgcaggagcagct-3'
Structural Information
- Molecular Formula
- C193H247N71O103P20S20
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5COP(=S)(O)OC6CC(OC6COP(=S)(O)OC7CC(OC7COP(=S)(O)OC8CC(OC8COP(=O)(OC9CC(OC9COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)O)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)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=NC2=C1N=C(NC2=O)N)S)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)O
- InChI
- InChI=1S/C193H247N71O103P20S20/c1-76-40-252(189(283)240-167(76)266)128-20-81(265)101(329-128)45-310-369(290,389)349-82-21-129(245-13-6-121(194)223-182(245)276)330-103(82)47-315-380(301,400)364-97-36-144(261-72-219-152-163(261)231-178(205)236-173(152)272)345-117(97)61-325-383(304,403)360-93-32-140(257-68-215-148-156(201)209-65-212-159(148)257)341-113(93)57-321-375(296,395)355-88-27-135(251-19-12-127(200)229-188(251)282)336-109(88)53-317-382(303,402)365-98-37-145(262-73-220-153-164(262)232-179(206)237-174(153)273)346-118(98)62-326-385(306,405)362-95-34-142(259-70-217-150-158(203)211-67-214-161(150)259)343-115(95)59-323-386(307,406)366-99-38-146(263-74-221-154-165(263)233-180(207)238-175(154)274)348-120(99)64-328-387(308,407)367-100-39-147(264-75-222-155-166(264)234-181(208)239-176(155)275)347-119(100)63-327-384(305,404)361-94-33-141(258-69-216-149-157(202)210-66-213-160(149)258)342-114(94)58-322-374(295,394)354-87-26-134(250-18-11-126(199)228-187(250)281)335-108(87)52-316-381(302,401)363-96-35-143(260-71-218-151-162(260)230-177(204)235-172(151)271)344-116(96)60-324-379(300,399)359-92-31-139(256-44-80(5)171(270)244-193(256)287)340-112(92)56-320-378(299,398)358-91-30-138(255-43-79(4)170(269)243-192(255)286)339-111(91)55-319-373(294,393)353-86-25-133(249-17-10-125(198)227-186(249)280)332-105(86)49-312-371(292,391)351-84-23-131(247-15-8-123(196)225-184(247)278)334-107(84)51-314-377(298,397)357-90-29-137(254-42-78(3)169(268)242-191(254)285)338-110(90)54-318-372(293,392)352-85-24-132(248-16-9-124(197)226-185(248)279)331-104(85)48-311-370(291,390)350-83-22-130(246-14-7-122(195)224-183(246)277)333-106(83)50-313-376(297,396)356-89-28-136(337-102(89)46-309-368(288,289)388)253-41-77(2)168(267)241-190(253)284/h6-19,40-44,65-75,81-120,128-147,265H,20-39,45-64H2,1-5H3,(H,290,389)(H,291,390)(H,292,391)(H,293,392)(H,294,393)(H,295,394)(H,296,395)(H,297,396)(H,298,397)(H,299,398)(H,300,399)(H,301,400)(H,302,401)(H,303,402)(H,304,403)(H,305,404)(H,306,405)(H,307,406)(H,308,407)(H2,194,223,276)(H2,195,224,277)(H2,196,225,278)(H2,197,226,279)(H2,198,227,280)(H2,199,228,281)(H2,200,229,282)(H2,201,209,212)(H2,202,210,213)(H2,203,211,214)(H,240,266,283)(H,241,267,284)(H,242,268,285)(H,243,269,286)(H,244,270,287)(H2,288,289,388)(H3,204,230,235,271)(H3,205,231,236,272)(H3,206,232,237,273)(H3,207,233,238,274)(H3,208,234,239,275)
- InChIKey
- SIBFBVHKQQZPFM-UHFFFAOYSA-N
- Compound name
- 1-[5-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-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-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-(dihydroxyphosphinothioyloxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)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]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]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]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]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]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6466.5513 | 311.5 |
[M+Na]+ | 6488.5332 | 311.5 |
[M-H]- | 6464.5367 | 311.5 |
[M+NH4]+ | 6483.5778 | 311.5 |
[M+K]+ | 6504.5072 | 311.5 |
[M+H-H2O]+ | 6448.5413 | 311.5 |
[M+HCOO]- | 6510.5422 | 311.5 |
[M+CH3COO]- | 6524.5579 | 311.5 |
[M+Na-2H]- | 6486.5187 | 311.5 |
[M]+ | 6465.5435 | 311.5 |
[M]- | 6465.5445 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.