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(2S,3S,4S,5R,6R)-5-Hydroxy-6-[(methoxymethyl)oxy]-1-N-phthalyl-2,3,4-tris(benzyloxy)oct-7-enamine
SpectraBase Compound ID 1MAskwSybBE
InChI InChI=1S/C39H41NO8/c1-3-33(48-27-44-2)35(41)37(47-26-30-19-11-6-12-20-30)36(46-25-29-17-9-5-10-18-29)34(45-24-28-15-7-4-8-16-28)23-40-38(42)31-21-13-14-22-32(31)39(40)43/h3-22,33-37,41H,1,23-27H2,2H3/t33-,34+,35-,36+,37+/m1/s1
InChIKey GEZZPVCGXZBECQ-VIMWANRLSA-N
Mol Weight 651.8 g/mol
Molecular Formula C39H41NO8
Exact Mass 651.283217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbwYqTNI3Cm
Name (2S,3S,4S,5R,6R)-5-Hydroxy-6-[(methoxymethyl)oxy]-1-N-phthalyl-2,3,4-tris(benzyloxy)oct-7-enamine
Alternate Name(s) 2,3,4-tri-O-benzyl-1,7,8-trideoxy-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-6-O-(methoxymethyl)-D-glycero-D-gulo-oct-7-enitol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H41NO8
InChI InChI=1S/C39H41NO8/c1-3-33(48-27-44-2)35(41)37(47-26-30-19-11-6-12-20-30)36(46-25-29-17-9-5-10-18-29)34(45-24-28-15-7-4-8-16-28)23-40-38(42)31-21-13-14-22-32(31)39(40)43/h3-22,33-37,41H,1,23-27H2,2H3/t33-,34+,35-,36+,37+/m1/s1
InChIKey GEZZPVCGXZBECQ-VIMWANRLSA-N
Molecular Weight 651.756 g/mol
SMILES O[C@@]([C@@]([C@]([C@](CN1C(c2ccccc2C1=O)=O)(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])([C@@](C=C)(OCOC)[H])[H]
SPLASH splash10-0006-9000000000-bb14c8fb4b25e059a5a3
Source of Spectrum J-57-1107-9
Wiley ID 1413169