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(5R)-2-(acetoxymethyl)-5-(6-(furan-3-ylmethylamino)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
SpectraBase Compound ID ALOTDJzVqYV
InChI InChI=1S/C21H23N5O8/c1-11(27)31-8-15-17(32-12(2)28)18(33-13(3)29)21(34-15)26-10-25-16-19(23-9-24-20(16)26)22-6-14-4-5-30-7-14/h4-5,7,9-10,15,17-18,21H,6,8H2,1-3H3,(H,22,23,24)/t15-,17-,18-,21-/m1/s1
InChIKey KOCYFJSYUCCFGS-QTQZEZTPSA-N
Mol Weight 473.44 g/mol
Molecular Formula C21H23N5O8
Exact Mass 473.154663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ccKN1e9zc
Name (5R)-2-(acetoxymethyl)-5-(6-(furan-3-ylmethylamino)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N5O8
InChI InChI=1S/C21H23N5O8/c1-11(27)31-8-15-17(32-12(2)28)18(33-13(3)29)21(34-15)26-10-25-16-19(23-9-24-20(16)26)22-6-14-4-5-30-7-14/h4-5,7,9-10,15,17-18,21H,6,8H2,1-3H3,(H,22,23,24)/t15-,17-,18-,21-/m1/s1
InChIKey KOCYFJSYUCCFGS-QTQZEZTPSA-N
Literature Reference DOI 10.1002_(SICI)1099-1565(199603)7_2_57
Molecular Weight 473.442 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])Cc1cocc1
SPLASH splash10-015l-9450000000-501a7c3c2c80320f3257
Source of Spectrum PA-7-63-63_30
Synonyms (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-((furan-3-ylmethyl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
Wiley ID 1800166