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{(2S,3R)-5-Hydroxy-2-[(R)-(4-methoxy-benzyloxy)-((4S,5R)-2,2,5-trimethyl-[1,3]dioxolan-4-yl)-methyl]-tetrahydro-furan-3-yl}-acetic acid tert-butyl ester
SpectraBase Compound ID IIBwWpdNdbY
InChI InChI=1S/C25H38O8/c1-15-21(33-25(5,6)31-15)23(29-14-16-8-10-18(28-7)11-9-16)22-17(12-19(26)30-22)13-20(27)32-24(2,3)4/h8-11,15,17,19,21-23,26H,12-14H2,1-7H3/t15-,17-,19?,21+,22+,23+/m1/s1
InChIKey REKYFHDVAPKYDQ-LALZUJDBSA-N
Mol Weight 466.6 g/mol
Molecular Formula C25H38O8
Exact Mass 466.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUSg5rJ6MMa
Name {(2S,3R)-5-Hydroxy-2-[(R)-(4-methoxy-benzyloxy)-((4S,5R)-2,2,5-trimethyl-[1,3]dioxolan-4-yl)-methyl]-tetrahydro-furan-3-yl}-acetic acid tert-butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.256668176 u
Formula C25H38O8
InChI InChI=1S/C25H38O8/c1-15-21(33-25(5,6)31-15)23(29-14-16-8-10-18(28-7)11-9-16)22-17(12-19(26)30-22)13-20(27)32-24(2,3)4/h8-11,15,17,19,21-23,26H,12-14H2,1-7H3/t15-,17-,19?,21+,22+,23+/m1/s1
InChIKey REKYFHDVAPKYDQ-LALZUJDBSA-N
Molecular Weight 466.571 g/mol
SMILES [C@@]1([C@@]([C@@]2([C@@](CC(OC(C)(C)C)=O)(CC(O2)O)[H])[H])(OCC2=CC=C(C=C2)OC)[H])(OC(C)(C)O[C@@]1(C)[H])[H]