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

View entire compound with spectra: 1 MS (GC)

(2S,3R,4R,5S)-5-[[(2S,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]-2-[(5-phenylisoxazol-3-yl)methyl]tetrahydropyran-3,4-diol
SpectraBase Compound ID I9oEyFHCO2h
InChI InChI=1S/C22H29NO6/c1-12(13(2)24)22-19(28-22)8-15-11-27-18(21(26)20(15)25)10-16-9-17(29-23-16)14-6-4-3-5-7-14/h3-7,9,12-13,15,18-22,24-26H,8,10-11H2,1-2H3/t12-,13-,15-,18-,19-,20+,21-,22-/m0/s1
InChIKey ZENQTNUVTQLMEQ-MRQXEPQISA-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 7JPxENcYt2k
Name (2S,3R,4R,5S)-5-[[(2S,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]-2-[(5-phenylisoxazol-3-yl)methyl]tetrahydropyran-3,4-diol
Alternate Name(s) (2S,3R,4R,5S)-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]-2-oxiranyl]methyl]-2-[(5-phenyl-3-isoxazolyl)methyl]oxane-3,4-diol (2S,3R,4R,5S)-5-[[(2S,3S)-3-[(2S,3S)-3-oxidanylbutan-2-yl]oxiran-2-yl]methyl]-2-[(5-phenyl-1,2-oxazol-3-yl)methyl]oxane-3,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO6
InChI InChI=1S/C22H29NO6/c1-12(13(2)24)22-19(28-22)8-15-11-27-18(21(26)20(15)25)10-16-9-17(29-23-16)14-6-4-3-5-7-14/h3-7,9,12-13,15,18-22,24-26H,8,10-11H2,1-2H3/t12-,13-,15-,18-,19-,20+,21-,22-/m0/s1
InChIKey ZENQTNUVTQLMEQ-MRQXEPQISA-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])(Cc1noc(c1)-c1ccccc1)[H])[H])[H])[H])(C)[H])(C)[H]
SPLASH splash10-0a4i-0900000000-a1d41327c123a944a9ec
Source of Spectrum E1-40-2567-8
Wiley ID 1599302