[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
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![[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/864d31fac5814724b7507055717b523d.png "[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate")
[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
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CAS No:
131673-55-7
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Formula:
C13H20N5O13P3
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Chemical Name:
[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
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Synonyms:
3'-5-MeTriazol-dTTP;Thymidine 5'-(tetrahydrogen triphosphate), 3'-deoxy-3'-(5-methyl-1H-1,2,3-triazol-1-yl)-;131673-55-7;3'-Deoxy-3'-(5-methyl-1H-1,2,3-triazol-1-yl)thymidine-5'-triphosphate;DTXSID20157181;[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate;3'-(5-Methyl-1H-1,2,3-triazol-1-yl)-3'-deoxythymidine 5'-triphosphoric acid;[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-3-(5-methyltriazol-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
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CAS No:
[hydroxy-[[(2S,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-(5-methyltriazol-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate Basic Attributes
547.25 g/mol
547.02704670 g/mol
DTXSID20157181
Computed Properties
Molecular Weight:547.25
XLogP3:-4.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:9
Exact Mass:547.02704670
Monoisotopic Mass:547.02704670
Topological Polar Surface Area:249
Heavy Atom Count:34
Complexity:1000
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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