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(2S,3R,4R,5S)-5-[[(2R,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]-2-[(2-phenyloxazol-5-yl)methyl]tetrahydropyran-3,4-diol

View entire compound with spectra: 1 MS (GC)

(2S,3R,4R,5S)-5-[[(2R,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]-2-[(2-phenyloxazol-5-yl)methyl]tetrahydropyran-3,4-diol
SpectraBase Compound ID AP81yXXVmM5
InChI InChI=1S/C22H29NO6/c1-12(13(2)24)21-18(29-21)8-15-11-27-17(20(26)19(15)25)9-16-10-23-22(28-16)14-6-4-3-5-7-14/h3-7,10,12-13,15,17-21,24-26H,8-9,11H2,1-2H3/t12-,13-,15-,17-,18+,19+,20-,21-/m0/s1
InChIKey GFUGDROARRTBDR-IENONYJWSA-N
Mol Weight 403.48 g/mol
Molecular Formula C22H29NO6
Exact Mass 403.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYvepGkOIQ2
Name (2S,3R,4R,5S)-5-[[(2R,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]-2-[(2-phenyloxazol-5-yl)methyl]tetrahydropyran-3,4-diol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO6
InChI InChI=1S/C22H29NO6/c1-12(13(2)24)21-18(29-21)8-15-11-27-17(20(26)19(15)25)9-16-10-23-22(28-16)14-6-4-3-5-7-14/h3-7,10,12-13,15,17-21,24-26H,8-9,11H2,1-2H3/t12-,13-,15-,17-,18+,19+,20-,21-/m0/s1
InChIKey GFUGDROARRTBDR-IENONYJWSA-N
Molecular Weight 403.475 g/mol
SMILES O[C@]([C@@]([C@@]1(O[C@@]1(C[C@]1(CO[C@]([C@@]([C@@]1(O)[H])(O)[H])(Cc1oc(-c2ccccc2)nc1)[H])[H])[H])[H])(C)[H])(C)[H]
SPLASH splash10-0a4i-0900000000-0f1d9b0274fa923e1270
Source of Spectrum E1-40-2568-21
Synonyms (2S,3R,4R,5S)-5-[[(2R,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]-2-oxiranyl]methyl]-2-[(2-phenyl-5-oxazolyl)methyl]oxane-3,4-diol (2S,3R,4R,5S)-5-[[(2R,3S)-3-[(2S,3S)-3-oxidanylbutan-2-yl]oxiran-2-yl]methyl]-2-[(2-phenyl-1,3-oxazol-5-yl)methyl]oxane-3,4-diol
Wiley ID 1599299