[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
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![[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c33eda37911a4e28aaa68ac86df3ce54.png "[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate")
[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
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CAS No:
78153-66-9
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Formula:
C11H17N4O13P3
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Chemical Name:
[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
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Synonyms:
ara-tubercidin 5'-triphosphate;Ara-tubercidin 5'-triphosphate;7-(5-O-(Hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phophinyl)-beta-D-arabinofuranosyl)-7H-pyrrolo(2,3-d)pyrimidin-4-amine;78153-66-9;[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate;7H-Pyrrolo(2,3-d)pyrimidin-4-amine, 7-(5-O-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phophinyl)-beta-D-arabinofuranosyl)-;7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-[5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-b-D-arabinofuranosyl]-
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CAS No:
[[(2R,3S,4S,5R)-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate Basic Attributes
506.19 g/mol
506.00049760 g/mol
Computed Properties
Molecular Weight:506.19
XLogP3:-5.2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:8
Exact Mass:506.00049760
Monoisotopic Mass:506.00049760
Topological Polar Surface Area:266
Heavy Atom Count:31
Complexity:799
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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