CID 16133635
.alpha.-dt16
Structural Information
- Molecular Formula
- C160H209N32O110P15
- 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(OC1CO)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)O
- InChI
- InChI=1S/C160H209N32O110P15/c1-65-33-177(145(211)161-129(65)195)113-17-81(194)98(273-113)50-257-303(227,228)289-83-19-115(179-35-67(3)131(197)163-147(179)213)275-100(83)52-259-305(231,232)291-85-21-117(181-37-69(5)133(199)165-149(181)215)277-102(85)54-261-307(235,236)293-87-23-119(183-39-71(7)135(201)167-151(183)217)279-104(87)56-263-309(239,240)295-89-25-121(185-41-73(9)137(203)169-153(185)219)281-106(89)58-265-311(243,244)297-91-27-123(187-43-75(11)139(205)171-155(187)221)283-108(91)60-267-313(247,248)299-93-29-125(189-45-77(13)141(207)173-157(189)223)285-110(93)62-269-315(251,252)301-95-31-127(191-47-79(15)143(209)175-159(191)225)287-112(95)64-271-317(255,256)302-96-32-128(192-48-80(16)144(210)176-160(192)226)286-111(96)63-270-316(253,254)300-94-30-126(190-46-78(14)142(208)174-158(190)224)284-109(94)61-268-314(249,250)298-92-28-124(188-44-76(12)140(206)172-156(188)222)282-107(92)59-266-312(245,246)296-90-26-122(186-42-74(10)138(204)170-154(186)220)280-105(90)57-264-310(241,242)294-88-24-120(184-40-72(8)136(202)168-152(184)218)278-103(88)55-262-308(237,238)292-86-22-118(182-38-70(6)134(200)166-150(182)216)276-101(86)53-260-306(233,234)290-84-20-116(180-36-68(4)132(198)164-148(180)214)274-99(84)51-258-304(229,230)288-82-18-114(272-97(82)49-193)178-34-66(2)130(196)162-146(178)212/h33-48,81-128,193-194H,17-32,49-64H2,1-16H3,(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,245,246)(H,247,248)(H,249,250)(H,251,252)(H,253,254)(H,255,256)(H,161,195,211)(H,162,196,212)(H,163,197,213)(H,164,198,214)(H,165,199,215)(H,166,200,216)(H,167,201,217)(H,168,202,218)(H,169,203,219)(H,170,204,220)(H,171,205,221)(H,172,206,222)(H,173,207,223)(H,174,208,224)(H,175,209,225)(H,176,210,226)
- InChIKey
- SZORFPXSVDZXJS-UHFFFAOYSA-N
- Compound name
- [3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]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]+ | 4803.7883 | 315.3 |
[M+Na]+ | 4825.7702 | 315.6 |
[M-H]- | 4801.7737 | 315.5 |
[M+NH4]+ | 4820.8148 | 315.4 |
[M+K]+ | 4841.7442 | 315.2 |
[M+H-H2O]+ | 4785.7783 | 314.9 |
[M+HCOO]- | 4847.7792 | 315.3 |
[M+CH3COO]- | 4861.7949 | 315.2 |
[M+Na-2H]- | 4823.7557 | 315.4 |
[M]+ | 4802.7805 | 315.5 |
[M]- | 4802.7815 | 315.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.