[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate
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![[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e0f685931e914ab1bbf7e4735f204a58.png "[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate")
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate
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CAS No:
28218-64-6
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Formula:
C10H17N5O16P4
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Chemical Name:
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate
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Synonyms:
adenosine 3'-diphosphate 5'-diphosphate;adenosine-5'-3'(2')-bis(diphosphate);ppApp;ppApp;adenosine 3',5'-bis(trihydrogen diphosphate);28218-64-6;Adenosine 3'-diphosphate 5'-diphosphate;Adenosine-5'-3'(2')-bis(diphosphate);SCHEMBL7260957;adenosine-3',5'-bis-diphosphate;DTXSID70950947;Adenosine 3',5'-bis(diphosphoric acid);[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate;Adenosine 3'-(trihydrogen diphosphate), 5'-(trihydrogen diphosphate);9-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine;N7Y
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CAS No:
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate Basic Attributes
587.16 g/mol
586.96207746 g/mol
Computed Properties
Molecular Weight:587.16
XLogP3:-6.8
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:10
Exact Mass:586.96207746
Monoisotopic Mass:586.96207746
Topological Polar Surface Area:326
Heavy Atom Count:35
Complexity:961
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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