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1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(4-phenylmethoxyphenyl)pyrimidine-2,4-dione
SpectraBase Compound ID 1lVeeQzg3TA
InChI InChI=1S/C22H22N2O6/c25-12-19-18(26)10-20(30-19)24-11-17(21(27)23-22(24)28)15-6-8-16(9-7-15)29-13-14-4-2-1-3-5-14/h1-9,11,18-20,25-26H,10,12-13H2,(H,23,27,28)/t18-,19+,20+/m0/s1
InChIKey MYZRIJVKDIOQFZ-XUVXKRRUSA-N
Mol Weight 410.43 g/mol
Molecular Formula C22H22N2O6
Exact Mass 410.147786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvCMisIXCBb
Name 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(4-phenylmethoxyphenyl)pyrimidine-2,4-dione
CAS Registry Number 108664-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O6
InChI InChI=1S/C22H22N2O6/c25-12-19-18(26)10-20(30-19)24-11-17(21(27)23-22(24)28)15-6-8-16(9-7-15)29-13-14-4-2-1-3-5-14/h1-9,11,18-20,25-26H,10,12-13H2,(H,23,27,28)/t18-,19+,20+/m0/s1
InChIKey MYZRIJVKDIOQFZ-XUVXKRRUSA-N
Molecular Weight 410.426 g/mol
SMILES N1C(C(=CN([C@]2(C[C@@]([C@](O2)(CO)[H])(O)[H])[H])C1=O)c1ccc(OCc2ccccc2)cc1)=O
SPLASH splash10-0006-0490000000-fdf06adc2d910fb1ec7b
Source of Spectrum J-52-3630-7
Synonyms 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(4-phenylmethoxyphenyl)pyrimidine-2,4-dione 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-(4-phenylmethoxyphenyl)pyrimidine-2,4-dione 5-(4-benzoxyphenyl)-1-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone 5-(4-benzyloxyphenyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Wiley ID 1373611