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9H-Purine, 6-(5-methyl-2-furanyl)-9-(2,3,5-tri-O-acetyl-.beta.-D-ribofuranosyl)-
SpectraBase Compound ID 9BmetmdwlT9
InChI InChI=1S/C21H22N4O8/c1-10-5-6-14(30-10)16-17-20(23-8-22-16)25(9-24-17)21-19(32-13(4)28)18(31-12(3)27)15(33-21)7-29-11(2)26/h5-6,8-9,15,18-19,21H,7H2,1-4H3/t15-,18-,19-,21-/m1/s1
InChIKey ZXFHNFLMUDVZIE-OBZYLPMUSA-N
Mol Weight 458.43 g/mol
Molecular Formula C21H22N4O8
Exact Mass 458.143764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmIdaDQ4bIJ
Name 9H-Purine, 6-(5-methyl-2-furanyl)-9-(2,3,5-tri-O-acetyl-.beta.-D-ribofuranosyl)-
Alternate Name(s) 6-(N-methylfur-2-yl)-9.beta.-(2',3',5'-tri-O-acetyl-D-ribofuranosyl)purine [(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-[6-(5-methylfuran-2-yl)-9H-purin-9-yl]oxolan-2-yl]methyl acetate
CAS Registry Number 83026-95-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N4O8
InChI InChI=1S/C21H22N4O8/c1-10-5-6-14(30-10)16-17-20(23-8-22-16)25(9-24-17)21-19(32-13(4)28)18(31-12(3)27)15(33-21)7-29-11(2)26/h5-6,8-9,15,18-19,21H,7H2,1-4H3/t15-,18-,19-,21-/m1/s1
InChIKey ZXFHNFLMUDVZIE-OBZYLPMUSA-N
Molecular Weight 458.427 g/mol
SMILES [C@@]1([n]2c3c(c(-c4oc(C)cc4)ncn3)nc2)([C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-0udv-8790100000-3ddab6f4e91750178352
Source of Spectrum J-47-4523-0
Wiley ID 1389777