CID 16133634
.alpha.-dt15
Structural Information
- Molecular Formula
- C150H196N30O103P14
- 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(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)O
- InChI
- InChI=1S/C150H196N30O103P14/c1-61-31-166(136(198)151-121(61)183)106-16-76(182)92(256-106)47-241-284(213,214)271-78-18-108(168-33-63(3)123(185)153-138(168)200)258-94(78)49-243-286(217,218)273-80-20-110(170-35-65(5)125(187)155-140(170)202)260-96(80)51-245-288(221,222)275-82-22-112(172-37-67(7)127(189)157-142(172)204)262-98(82)53-247-290(225,226)277-84-24-114(174-39-69(9)129(191)159-144(174)206)264-100(84)55-249-292(229,230)279-86-26-116(176-41-71(11)131(193)161-146(176)208)266-102(86)57-251-294(233,234)281-88-28-118(178-43-73(13)133(195)163-148(178)210)268-104(88)59-253-296(237,238)283-90-30-120(180-45-75(15)135(197)165-150(180)212)269-105(90)60-254-297(239,240)282-89-29-119(179-44-74(14)134(196)164-149(179)211)267-103(89)58-252-295(235,236)280-87-27-117(177-42-72(12)132(194)162-147(177)209)265-101(87)56-250-293(231,232)278-85-25-115(175-40-70(10)130(192)160-145(175)207)263-99(85)54-248-291(227,228)276-83-23-113(173-38-68(8)128(190)158-143(173)205)261-97(83)52-246-289(223,224)274-81-21-111(171-36-66(6)126(188)156-141(171)203)259-95(81)50-244-287(219,220)272-79-19-109(169-34-64(4)124(186)154-139(169)201)257-93(79)48-242-285(215,216)270-77-17-107(255-91(77)46-181)167-32-62(2)122(184)152-137(167)199/h31-45,76-120,181-182H,16-30,46-60H2,1-15H3,(H,213,214)(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H,151,183,198)(H,152,184,199)(H,153,185,200)(H,154,186,201)(H,155,187,202)(H,156,188,203)(H,157,189,204)(H,158,190,205)(H,159,191,206)(H,160,192,207)(H,161,193,208)(H,162,194,209)(H,163,195,210)(H,164,196,211)(H,165,197,212)
- InChIKey
- ZDAMSCLJLJVJHR-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-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]+ | 4499.7423 | 316.3 |
[M+Na]+ | 4521.7242 | 317.0 |
[M-H]- | 4497.7277 | 316.8 |
[M+NH4]+ | 4516.7688 | 316.5 |
[M+K]+ | 4537.6982 | 316.2 |
[M+H-H2O]+ | 4481.7323 | 315.7 |
[M+HCOO]- | 4543.7332 | 316.4 |
[M+CH3COO]- | 4557.7489 | 316.3 |
[M+Na-2H]- | 4519.7097 | 316.9 |
[M]+ | 4498.7345 | 316.7 |
[M]- | 4498.7355 | 316.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.