[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
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![[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cb96b1abbea24a51b9320f73811548b6.png "[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate")
[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
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CAS No:
135052-71-0
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Formula:
C10H15N5O11P2
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Chemical Name:
[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
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Synonyms:
3-isoisoguanosine 5'-diphosphate;3-ribofuranosylisoguanosine 5'-diphosphate;135052-71-0;3-Isoisoguanosine 5'-diphosphate;3-Ribofuranosylisoguanosine 5'-diphosphate;DTXSID00928871;6-Amino-3-{5-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-3,9-dihydro-2H-purin-2-one;2H-Purin-2-one, 6-amino-1,3-dihydro-3-(5-O-(hydroxy(phosphonooxy)phosphinyl)-beta-D-ribofuranosyl)-
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CAS No:
[(2R,3S,4R,5R)-5-(6-amino-2-oxo-7H-purin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate Basic Attributes
443.20 g/mol
443.02433031 g/mol
Computed Properties
Molecular Weight:443.20
XLogP3:-5.1
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:6
Exact Mass:443.02433031
Monoisotopic Mass:443.02433031
Topological Polar Surface Area:250
Heavy Atom Count:28
Complexity:760
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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