[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid
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![[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f34fda23006b418fbfe6eae5c8b8eae4.png "[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid")
[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid
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CAS No:
116015-32-8
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Formula:
C11H18N5O12P3
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Chemical Name:
[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid
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Synonyms:
Me-AzddTTP;116015-32-8;5'-Thymidylic acid, 3'-azido-3'-deoxy-, monoanhydride with methylenebis(phosphonic acid);5'-Thymidylic acid, 3'-azido-3'-deoxy-, monoanhydride with methylenebis[phosphonic acid];DTXSID40151267;3'-Azido-5'-(beta-gamma-methylene)-deoxythymidine-triphosphate;3'-Azido-5'-(.beta.-.gamma.-methylene)-deoxythymidine-triphosphate;[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]methylphosphonic acid;3'-Azido-5'-O-[(dihydroxyphosphinylmethylhydroxyphosphinyloxy)hydroxyphosphinyl]-3'-deoxythymidine
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CAS No:
[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid Basic Attributes
505.21 g/mol
505.01648202 g/mol
DTXSID40151267
Computed Properties
Molecular Weight:505.21
XLogP3:-3.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:9
Exact Mass:505.01648202
Monoisotopic Mass:505.01648202
Topological Polar Surface Area:224
Heavy Atom Count:31
Complexity:973
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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