[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-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]methylphosphonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/16ce6c7c8e0d4f27907761d0fe45e574.png "[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid")
[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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CAS No:
115991-79-2
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Formula:
C11H17N5O9P2
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Chemical Name:
[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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Synonyms:
Methylene-Az-ddTDP;115991-79-2;Thymidine, 3'-azido-3'-deoxy-, 5'-(hydrogen (phosphonomethyl)phosphonate);Thymidine, 3'-azido-3'-deoxy-, 5'-[hydrogen (phosphonomethyl)phosphonate];DTXSID70151250;3'-Azido-3'-deoxy-5'-thymidinealpha,beta-methylenediophosphate;[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid;3'-Azido-3'-deoxy-5'-thymidine.alpha.,.beta.-methylenediophosphate;[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]methylphosphonic acid
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CAS No:
[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid Basic Attributes
425.23 g/mol
425.05015113 g/mol
DTXSID70151250
Computed Properties
Molecular Weight:425.23
XLogP3:-2.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:425.05015113
Monoisotopic Mass:425.05015113
Topological Polar Surface Area:177
Heavy Atom Count:27
Complexity:804
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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