CID 16130127
(dt)20-[3'-f-tmp]
Structural Information
- Molecular Formula
- C210H273FN42O144P20
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)OP(=O)(O)OCC3C(CC(O3)N4C=C(C(=O)NC4=O)C)OP(=O)(O)OCC5C(CC(O5)N6C=C(C(=O)NC6=O)C)OP(=O)(O)OCC7C(CC(O7)N8C=C(C(=O)NC8=O)C)OP(=O)(O)OCC9C(CC(O9)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=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=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=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=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=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=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=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=C(C(=O)NC1=O)C)F
- InChI
- InChI=1S/C210H273FN42O144P20/c1-85-43-233(190(276)212-169(85)255)148-22-106(211)128(358-148)65-337-398(297,298)379-108-24-150(235-45-87(3)171(257)214-192(235)278)360-130(108)67-339-400(301,302)381-110-26-152(237-47-89(5)173(259)216-194(237)280)362-132(110)69-341-402(305,306)383-112-28-154(239-49-91(7)175(261)218-196(239)282)364-134(112)71-343-404(309,310)385-114-30-156(241-51-93(9)177(263)220-198(241)284)366-136(114)73-345-406(313,314)387-116-32-158(243-53-95(11)179(265)222-200(243)286)368-138(116)75-347-408(317,318)389-118-34-160(245-55-97(13)181(267)224-202(245)288)370-140(118)77-349-410(321,322)391-120-36-162(247-57-99(15)183(269)226-204(247)290)372-142(120)79-351-412(325,326)393-122-38-164(249-59-101(17)185(271)228-206(249)292)374-144(122)81-353-414(329,330)395-124-40-166(251-61-103(19)187(273)230-208(251)294)376-146(124)83-355-416(333,334)397-126-42-168(253-63-105(21)189(275)232-210(253)296)377-147(126)84-356-417(335,336)396-125-41-167(252-62-104(20)188(274)231-209(252)295)375-145(125)82-354-415(331,332)394-123-39-165(250-60-102(18)186(272)229-207(250)293)373-143(123)80-352-413(327,328)392-121-37-163(248-58-100(16)184(270)227-205(248)291)371-141(121)78-350-411(323,324)390-119-35-161(246-56-98(14)182(268)225-203(246)289)369-139(119)76-348-409(319,320)388-117-33-159(244-54-96(12)180(266)223-201(244)287)367-137(117)74-346-407(315,316)386-115-31-157(242-52-94(10)178(264)221-199(242)285)365-135(115)72-344-405(311,312)384-113-29-155(240-50-92(8)176(262)219-197(240)283)363-133(113)70-342-403(307,308)382-111-27-153(238-48-90(6)174(260)217-195(238)281)361-131(111)68-340-401(303,304)380-109-25-151(236-46-88(4)172(258)215-193(236)279)359-129(109)66-338-399(299,300)378-107-23-149(357-127(107)64-254)234-44-86(2)170(256)213-191(234)277/h43-63,106-168,254H,22-42,64-84H2,1-21H3,(H,297,298)(H,299,300)(H,301,302)(H,303,304)(H,305,306)(H,307,308)(H,309,310)(H,311,312)(H,313,314)(H,315,316)(H,317,318)(H,319,320)(H,321,322)(H,323,324)(H,325,326)(H,327,328)(H,329,330)(H,331,332)(H,333,334)(H,335,336)(H,212,255,276)(H,213,256,277)(H,214,257,278)(H,215,258,279)(H,216,259,280)(H,217,260,281)(H,218,261,282)(H,219,262,283)(H,220,263,284)(H,221,264,285)(H,222,265,286)(H,223,266,287)(H,224,267,288)(H,225,268,289)(H,226,269,290)(H,227,270,291)(H,228,271,292)(H,229,272,293)(H,230,273,294)(H,231,274,295)(H,232,275,296)
- InChIKey
- KPDHNZLOXTYBJV-UHFFFAOYSA-N
- Compound name
- [3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-fluoro-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-(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-(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-(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-(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-(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-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6326.0143 | 311.6 |
[M+Na]+ | 6347.9962 | 311.6 |
[M-H]- | 6323.9997 | 311.6 |
[M+NH4]+ | 6343.0408 | 311.6 |
[M+K]+ | 6363.9702 | 311.6 |
[M+H-H2O]+ | 6308.0043 | 311.6 |
[M+HCOO]- | 6370.0052 | 311.6 |
[M+CH3COO]- | 6384.0209 | 311.6 |
[M+Na-2H]- | 6345.9817 | 311.6 |
[M]+ | 6325.0065 | 311.7 |
[M]- | 6325.0075 | 311.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.