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(Z)-(7S,9R,10S)-4-Methoxy-7-[2-(4-methoxybenzyl)ethyl]-9-methoxymethyl-10-methyl-7,8,9,10,11,14-hexahydro-6-oxabenzocyclodecen-5-one

View entire compound with spectra: 1 NMR, and 2 MS (GC)

(Z)-(7S,9R,10S)-4-Methoxy-7-[2-(4-methoxybenzyl)ethyl]-9-methoxymethyl-10-methyl-7,8,9,10,11,14-hexahydro-6-oxabenzocyclodecen-5-one
SpectraBase Compound ID HbRJITXX3ap
InChI InChI=1S/C29H38O7/c1-22-10-7-8-13-24-14-9-15-26(32-3)28(24)29(30)36-25(18-27(22)35-20-31-2)16-17-33-21-34-19-23-11-5-4-6-12-23/h4-9,11-12,14-15,22,25,27H,10,13,16-21H2,1-3H3/b8-7+
InChIKey XHSRJOVCTXMQGF-BQYQJAHWSA-N
Mol Weight 498.6 g/mol
Molecular Formula C29H38O7
Exact Mass 498.261754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CeHXfn7OduK
Name (Z)-(7S,9R,10S)-4-Methoxy-7-[2-(4-methoxybenzyl)ethyl]-9-methoxymethyl-10-methyl-7,8,9,10,11,14-hexahydro-6-oxabenzocyclodecen-5-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.261753557 u
Formula C29H38O7
InChI InChI=1S/C29H38O7/c1-22-10-7-8-13-24-14-9-15-26(32-3)28(24)29(30)36-25(18-27(22)35-20-31-2)16-17-33-21-34-19-23-11-5-4-6-12-23/h4-9,11-12,14-15,22,25,27H,10,13,16-21H2,1-3H3/b8-7+
InChIKey XHSRJOVCTXMQGF-BQYQJAHWSA-N
Molecular Weight 498.616 g/mol
SMILES C1(C2=C(OC)C=CC=C2C\C=C\CC(C(CC(O1)CCOCOCC1=CC=CC=C1)OCOC)C)=O