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(+)-3,4,5-Tri-O-allyl-2,6-di-O-benzyl-1-O-(p-methoxybenzyl)-myo-insitol

View entire compound with spectra: 1 MS (GC)

(+)-3,4,5-Tri-O-allyl-2,6-di-O-benzyl-1-O-(p-methoxybenzyl)-myo-insitol
SpectraBase Compound ID 7ypnkHxearn
InChI InChI=1S/C37H44O7/c1-5-22-39-32-33(40-23-6-2)35(42-25-28-14-10-8-11-15-28)37(44-27-30-18-20-31(38-4)21-19-30)36(34(32)41-24-7-3)43-26-29-16-12-9-13-17-29/h5-21,32-37H,1-3,22-27H2,4H3/t32-,33-,34+,35-,36-,37-/m1/s1
InChIKey BDDWPUBTQOLZLT-JARGVEKNSA-N
Mol Weight 600.8 g/mol
Molecular Formula C37H44O7
Exact Mass 600.308704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3Jn9c0B63G
Name (+)-3,4,5-Tri-O-allyl-2,6-di-O-benzyl-1-O-(p-methoxybenzyl)-myo-insitol
Alternate Name(s) 1-Methoxy-4-({[(2R,3R,5S,6R)-3,4,5-tris(allyloxy)-2,6-bis(benzyloxy)cyclohexyl]oxy}methyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H44O7
InChI InChI=1S/C37H44O7/c1-5-22-39-32-33(40-23-6-2)35(42-25-28-14-10-8-11-15-28)37(44-27-30-18-20-31(38-4)21-19-30)36(34(32)41-24-7-3)43-26-29-16-12-9-13-17-29/h5-21,32-37H,1-3,22-27H2,4H3/t32-,33-,34+,35-,36-,37-/m1/s1
InChIKey BDDWPUBTQOLZLT-JARGVEKNSA-N
Molecular Weight 600.752 g/mol
SMILES [C@]1([C@@]([C@@](OCC=C)([C@@]([C@]([C@]1(OCc1ccccc1)[H])(OCC=C)[H])(OCC=C)[H])[H])(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H]
SPLASH splash10-0229-0900252000-bbe0873fd832a64ef9a9
Source of Spectrum J-61-5909-24
Wiley ID 1410169