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1H-Cyclopent[C]isoxazole, 1-[2,3:5,6-bis-o-(1-methylethylidene)-alpha-D-mannofuranosyl]hexahydro-4,5-bis(phenylmethoxy)-, [3as-(3A
SpectraBase Compound ID GGi9uU1FJCo
InChI InChI=1S/C25H35NO7.C7H8O/c1-24(2)28-14-19(31-24)20-21-22(33-25(3,4)32-21)23(30-20)26-18-11-17(10-16(18)13-29-26)27-12-15-8-6-5-7-9-15;8-6-7-4-2-1-3-5-7/h5-9,16-23H,10-14H2,1-4H3;1-5,8H,6H2
InChIKey CAEQQOVMWLRRRF-UHFFFAOYSA-N
Mol Weight 569.7 g/mol
Molecular Formula C32H43NO8
Exact Mass 569.298867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hCnVslkB2I
Name 1H-Cyclopent[C]isoxazole, 1-[2,3:5,6-bis-o-(1-methylethylidene)-alpha-D-mannofuranosyl]hexahydro-4,5-bis(phenylmethoxy)-, [3as-(3A
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 569.298867341 u
Formula C32H43NO8
InChI InChI=1S/C25H35NO7.C7H8O/c1-24(2)28-14-19(31-24)20-21-22(33-25(3,4)32-21)23(30-20)26-18-11-17(10-16(18)13-29-26)27-12-15-8-6-5-7-9-15;8-6-7-4-2-1-3-5-7/h5-9,16-23H,10-14H2,1-4H3;1-5,8H,6H2
InChIKey CAEQQOVMWLRRRF-UHFFFAOYSA-N
Molecular Weight 569.695 g/mol
Nominal Mass 569 u
SMILES OCc1ccccc1.C1(OC(C2C1OC(O2)(C)C)N1OCC2C1CC(C2)OCc1ccccc1)C1OC(OC1)(C)C