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(2R,3R,4R,5R)-2-(6-((Z)-4-acetoxy-3-methylbut-2-enylamino)-9H-purin-9-yl)-5-(acetoxymethyl)tetrahydrofuran-3,4-diyl diacetate
SpectraBase Compound ID 35WIWxc21PI
InChI InChI=1S/C23H29N5O9/c1-12(8-33-13(2)29)6-7-24-21-18-22(26-10-25-21)28(11-27-18)23-20(36-16(5)32)19(35-15(4)31)17(37-23)9-34-14(3)30/h6,10-11,17,19-20,23H,7-9H2,1-5H3,(H,24,25,26)/b12-6-/t17-,19-,20-,23-/m1/s1
InChIKey HPLIXZZBRXYQRL-RCPQBPKJSA-N
Mol Weight 519.51 g/mol
Molecular Formula C23H29N5O9
Exact Mass 519.196528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2P6BReSDEuK
Name (2R,3R,4R,5R)-2-(6-((Z)-4-acetoxy-3-methylbut-2-enylamino)-9H-purin-9-yl)-5-(acetoxymethyl)tetrahydrofuran-3,4-diyl diacetate
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Formula C23H29N5O9
InChI InChI=1S/C23H29N5O9/c1-12(8-33-13(2)29)6-7-24-21-18-22(26-10-25-21)28(11-27-18)23-20(36-16(5)32)19(35-15(4)31)17(37-23)9-34-14(3)30/h6,10-11,17,19-20,23H,7-9H2,1-5H3,(H,24,25,26)/b12-6-/t17-,19-,20-,23-/m1/s1
InChIKey HPLIXZZBRXYQRL-RCPQBPKJSA-N
Literature Reference DOI 10.1002_(SICI)1099-1565(199603)7_2_57
Molecular Weight 519.511 g/mol
SMILES N(c1ncnc2c1nc[n]2[C@@]1(O[C@](COC(C)=O)([C@@](OC(C)=O)([C@]1(OC(C)=O)[H])[H])[H])[H])C\C=C/(COC(C)=O)C
SPLASH splash10-0udl-9270000000-7460ed7585bd7a42307e
Source of Spectrum PA-7-63-63_11
Synonyms (2R,3R,4R,5R)-2-(6-(((Z)-4-acetoxy-3-methylbut-2-en-1-yl)amino)-9H-purin-9-yl)-5-(acetoxymethyl)tetrahydrofuran-3,4-diyl diacetate
Wiley ID 1800145