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(2'S,3'S)-Methyl 2,6-Di-O-benzyl-3,4-O-(2',3'-dimethoxybutane-2',3'-diyl)-.alpha.,D-mannopyranoside
SpectraBase Compound ID EkturKYcFNf
InChI InChI=1S/C27H36O8/c1-26(29-4)27(2,30-5)35-23-22(34-26)21(18-31-16-19-12-8-6-9-13-19)33-25(28-3)24(23)32-17-20-14-10-7-11-15-20/h6-15,21-25H,16-18H2,1-5H3/t21-,22-,23+,24+,25+,26+,27+/m1/s1
InChIKey WRCQDCYCEMBNQE-KZPPUNKBSA-N
Mol Weight 488.6 g/mol
Molecular Formula C27H36O8
Exact Mass 488.241018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwvlzElLo6x
Name (2'S,3'S)-Methyl 2,6-Di-O-benzyl-3,4-O-(2',3'-dimethoxybutane-2',3'-diyl)-.alpha.,D-mannopyranoside
Alternate Name(s) (2S,3S,4aR,5R,7S,8S,8aS)-8-(benzyloxy)-5-[(benzyloxy)methyl]-2,3,7-trimethoxy-2,3-dimethyl-hexahydro-2H-pyrano[3,4-b][1,4]dioxine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O8
InChI InChI=1S/C27H36O8/c1-26(29-4)27(2,30-5)35-23-22(34-26)21(18-31-16-19-12-8-6-9-13-19)33-25(28-3)24(23)32-17-20-14-10-7-11-15-20/h6-15,21-25H,16-18H2,1-5H3/t21-,22-,23+,24+,25+,26+,27+/m1/s1
InChIKey WRCQDCYCEMBNQE-KZPPUNKBSA-N
Molecular Weight 488.577 g/mol
SMILES [C@@]12([C@](O[C@@]([C@](O2)(OC)C)(OC)C)([C@@](COCc2ccccc2)(O[C@@]([C@]1(OCc1ccccc1)[H])(OC)[H])[H])[H])[H]
SPLASH splash10-0006-9010000000-a658b69c6c0c055fb5df
Source of Spectrum KC-0-2031-45
Wiley ID 822781