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(4R,5S,6R)-Ethyl 4,5,6-trihydroxy-7-triphenylmethoxyheptanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(4R,5S,6R)-Ethyl 4,5,6-trihydroxy-7-triphenylmethoxyheptanoate
SpectraBase Compound ID IfD8Yu3GuQ3
InChI InChI=1S/C28H32O6/c1-2-33-26(31)19-18-24(29)27(32)25(30)20-34-28(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,24-25,27,29-30,32H,2,18-20H2,1H3/t24-,25-,27+/m1/s1
InChIKey GJOCSZCARMCVJC-SLQPCKNISA-N
Mol Weight 464.6 g/mol
Molecular Formula C28H32O6
Exact Mass 464.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DqXjsRfAtBm
Name (4R,5S,6R)-Ethyl 4,5,6-trihydroxy-7-triphenylmethoxyheptanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.219888744 u
Formula C28H32O6
InChI InChI=1S/C28H32O6/c1-2-33-26(31)19-18-24(29)27(32)25(30)20-34-28(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,24-25,27,29-30,32H,2,18-20H2,1H3/t24-,25-,27+/m1/s1
InChIKey GJOCSZCARMCVJC-SLQPCKNISA-N
Molecular Weight 464.558 g/mol
SMILES C(OC[C@]([C@]([C@@](CCC(=O)OCC)(O)[H])(O)[H])(O)[H])(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1