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(2R,3R,4S,5S,6R)-2-Hexoxy-6-(hydroxymethyl)oxane-3,4,5-triol, tetraacetate

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(2R,3R,4S,5S,6R)-2-Hexoxy-6-(hydroxymethyl)oxane-3,4,5-triol, tetraacetate
SpectraBase Compound ID 5CPcklmDrxC
InChI InChI=1S/C20H32O10/c1-6-7-8-9-10-25-20-19(29-15(5)24)18(28-14(4)23)17(27-13(3)22)16(30-20)11-26-12(2)21/h16-20H,6-11H2,1-5H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey DLJCQAHSSJRRFF-OUUBHVDSSA-N
Mol Weight 432.5 g/mol
Molecular Formula C20H32O10
Exact Mass 432.199547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IHn6KC0XYgH
Name (2R,3R,4S,5S,6R)-2-Hexoxy-6-(hydroxymethyl)oxane-3,4,5-triol, tetraacetate
Comments Computed using HOSE algorithm
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Exact Mass 432.199547220 u
Formula C20H32O10
InChI InChI=1S/C20H32O10/c1-6-7-8-9-10-25-20-19(29-15(5)24)18(28-14(4)23)17(27-13(3)22)16(30-20)11-26-12(2)21/h16-20H,6-11H2,1-5H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey DLJCQAHSSJRRFF-OUUBHVDSSA-N
Molecular Weight 432.466 g/mol
SMILES CCCCCCO[C@@]1(O[C@@]([C@]([C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])(COC(=O)C)[H])[H]