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(2S,3S)-5-(4-Methoxybenzoyloxy)-3,5-bis(4-methoxyphenyl)pentane-1,2-diol

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

(2S,3S)-5-(4-Methoxybenzoyloxy)-3,5-bis(4-methoxyphenyl)pentane-1,2-diol
SpectraBase Compound ID AcDruGt0ip6
InChI InChI=1S/C27H30O7/c1-31-21-10-4-18(5-11-21)24(25(29)17-28)16-26(19-6-12-22(32-2)13-7-19)34-27(30)20-8-14-23(33-3)15-9-20/h4-15,24-26,28-29H,16-17H2,1-3H3/t24-,25+,26?/m0/s1
InChIKey LSOVXKZBAWLGRG-LHJLODMPSA-N
Mol Weight 466.53 g/mol
Molecular Formula C27H30O7
Exact Mass 466.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LVSUCMSXWVK
Name (2S,3S)-5-(4-Methoxybenzoyloxy)-3,5-bis(4-methoxyphenyl)pentane-1,2-diol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.199153299 u
Formula C27H30O7
InChI InChI=1S/C27H30O7/c1-31-21-10-4-18(5-11-21)24(25(29)17-28)16-26(19-6-12-22(32-2)13-7-19)34-27(30)20-8-14-23(33-3)15-9-20/h4-15,24-26,28-29H,16-17H2,1-3H3/t24-,25+,26?/m0/s1
InChIKey LSOVXKZBAWLGRG-LHJLODMPSA-N
Molecular Weight 466.530 g/mol
SMILES C(OC(C[C@@](C1=CC=C(C=C1)OC)([C@](O)(CO)[H])[H])C=1C=CC(=CC1)OC)(C1=CC=C(C=C1)OC)=O