[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate
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![[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a0dc223f89b84c4cae6ff8825a86b397.png "[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate")
[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate
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CAS No:
78679-19-3
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Formula:
C45H81N5O14P2
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Chemical Name:
[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate
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Synonyms:
9 beta-D-arabinofuranosyladenine 5'-diphosphate-5'-1,2-dipalmitin;ARA-ADP-dipalmitin;9beta-D-Arabinofuranosyladenine 5'-diphosphate-5'-1,2-dipalmitin;78679-19-3;Ara-ADP-dipalmitin;DTXSID40229233;9H-Purin-6-amine, 9-(5-O-(1,3-dihydroxy-6-((1-oxohexadecyl)oxy)-9-oxo-2,4,8-trioxa-1,3-diphosphatetracos-1-yl)-beta-D-arabinofuranosyl)-, P,P'-dioxide, (R)-
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CAS No:
[(2R)-3-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate Basic Attributes
978.1 g/mol
977.52552627 g/mol
DTXSID40229233
Computed Properties
Molecular Weight:978.1
XLogP3:10.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:42
Exact Mass:977.52552627
Monoisotopic Mass:977.52552627
Topological Polar Surface Area:274
Heavy Atom Count:66
Complexity:1410
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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