CID 16197351
Act ggc tcc att tct tgc tc
Structural Information
- Molecular Formula
- C193H250N62O127P20
- 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(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=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=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)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)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O
- InChI
- InChI=1S/C193H250N62O127P20/c1-78-43-243(186(275)228-165(78)257)140-30-93(370-384(286,287)325-51-106-86(256)23-133(344-106)236-16-9-126(194)215-179(236)268)114(351-140)59-332-386(290,291)367-90-27-137(240-20-13-130(198)219-183(240)272)349-112(90)57-330-399(316,317)380-103-40-150(253-75-212-155-162(253)222-176(203)225-173(155)265)361-123(103)68-341-397(312,313)377-100-37-147(250-50-85(8)172(264)235-193(250)282)357-120(100)65-338-393(304,305)373-96-33-143(246-46-81(4)168(260)231-189(246)278)353-116(96)61-334-387(292,293)365-88-25-135(238-18-11-128(196)217-181(238)270)347-110(88)55-328-392(302,303)372-95-32-142(245-45-80(3)167(259)230-188(245)277)355-118(95)63-336-394(306,307)374-97-34-144(247-47-82(5)169(261)232-190(247)279)356-119(97)64-337-395(308,309)375-98-35-145(248-48-83(6)170(262)233-191(248)280)358-121(98)66-339-401(320,321)379-102-39-149(252-74-211-154-159(202)207-72-209-161(154)252)360-122(102)67-340-390(298,299)369-92-29-139(242-22-15-132(200)221-185(242)274)345-108(92)53-326-385(288,289)364-87-24-134(237-17-10-127(195)216-180(237)269)346-109(87)54-327-391(300,301)371-94-31-141(244-44-79(2)166(258)229-187(244)276)352-115(94)60-333-389(296,297)368-91-28-138(241-21-14-131(199)220-184(241)273)350-113(91)58-331-400(318,319)381-104-41-151(254-76-213-156-163(254)223-177(204)226-174(156)266)363-125(104)70-343-402(322,323)382-105-42-152(255-77-214-157-164(255)224-178(205)227-175(157)267)362-124(105)69-342-396(310,311)376-99-36-146(249-49-84(7)171(263)234-192(249)281)354-117(99)62-335-388(294,295)366-89-26-136(239-19-12-129(197)218-182(239)271)348-111(89)56-329-398(314,315)378-101-38-148(359-107(101)52-324-383(283,284)285)251-73-210-153-158(201)206-71-208-160(153)251/h9-22,43-50,71-77,86-125,133-152,256H,23-42,51-70H2,1-8H3,(H,286,287)(H,288,289)(H,290,291)(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)(H2,194,215,268)(H2,195,216,269)(H2,196,217,270)(H2,197,218,271)(H2,198,219,272)(H2,199,220,273)(H2,200,221,274)(H2,201,206,208)(H2,202,207,209)(H,228,257,275)(H,229,258,276)(H,230,259,277)(H,231,260,278)(H,232,261,279)(H,233,262,280)(H,234,263,281)(H,235,264,282)(H2,283,284,285)(H3,203,222,225,265)(H3,204,223,226,266)(H3,205,224,227,267)
- InChIKey
- FRGOAPYIVFOZNB-UHFFFAOYSA-N
- Compound name
- [3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-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-(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-(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-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-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]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]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]methyl [5-(6-aminopurin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6087.9833 | 311.5 |
[M+Na]+ | 6109.9652 | 311.5 |
[M-H]- | 6085.9687 | 311.5 |
[M+NH4]+ | 6105.0098 | 311.5 |
[M+K]+ | 6125.9392 | 311.5 |
[M+H-H2O]+ | 6069.9733 | 311.5 |
[M+HCOO]- | 6131.9742 | 311.5 |
[M+CH3COO]- | 6145.9899 | 311.5 |
[M+Na-2H]- | 6107.9507 | 311.5 |
[M]+ | 6086.9755 | 311.5 |
[M]- | 6086.9765 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.