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(2R,3R,4R,5R,6S)-2-[3-[4-[1,3-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]propoxy]-6-methyloxane-3,4,5-triol, 6me derivative

View entire compound with spectra: 1 NMR

(2R,3R,4R,5R,6S)-2-[3-[4-[1,3-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]propoxy]-6-methyloxane-3,4,5-triol, 6me derivative
SpectraBase Compound ID E1C21T8l6Cf
InChI InChI=1S/C32H48O11/c1-20-28(37-6)30(39-8)31(40-9)32(42-20)41-16-10-11-21-12-14-24(25(17-21)35-4)43-27(19-33-2)29(38-7)22-13-15-23(34-3)26(18-22)36-5/h12-15,17-18,20,27-32H,10-11,16,19H2,1-9H3/t20-,27?,28-,29?,30+,31+,32+/m0/s1
InChIKey BAUFGLWZWIXHAO-YGFIVJSDSA-N
Mol Weight 608.7 g/mol
Molecular Formula C32H48O11
Exact Mass 608.319662 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ai7Nw6q8QoB
Name (2R,3R,4R,5R,6S)-2-[3-[4-[1,3-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]propoxy]-6-methyloxane-3,4,5-triol, 6me derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 608.319662355 u
Formula C32H48O11
InChI InChI=1S/C32H48O11/c1-20-28(37-6)30(39-8)31(40-9)32(42-20)41-16-10-11-21-12-14-24(25(17-21)35-4)43-27(19-33-2)29(38-7)22-13-15-23(34-3)26(18-22)36-5/h12-15,17-18,20,27-32H,10-11,16,19H2,1-9H3/t20-,27?,28-,29?,30+,31+,32+/m0/s1
InChIKey BAUFGLWZWIXHAO-YGFIVJSDSA-N
Molecular Weight 608.725 g/mol
SMILES C1(=C(C=CC(=C1)C(C(COC)OC1=C(C=C(C=C1)CCCO[C@@]1(O[C@]([C@@]([C@]([C@]1(OC)[H])(OC)[H])(OC)[H])(C)[H])[H])OC)OC)OC)OC