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(3R)-3-{(1S)-1-Hydroxy-2-[(4-methoxybenzyl)oxy]ethyl}-13-methoxy-4,5,6,7-tetrahydro-2-benzoxacycloundecin-1(3H)-one
SpectraBase Compound ID LUoBbSa5Wit
InChI InChI=1S/C25H30O6/c1-28-20-14-12-18(13-15-20)16-30-17-21(26)22-10-6-4-3-5-8-19-9-7-11-23(29-2)24(19)25(27)31-22/h5,7-9,11-15,21-22,26H,3-4,6,10,16-17H2,1-2H3/b8-5-/t21-,22+/m0/s1
InChIKey RRMZSFNWSPJTET-OFMSAZMGSA-N
Mol Weight 426.51 g/mol
Molecular Formula C25H30O6
Exact Mass 426.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hdyvcLRiUu
Name (3R)-3-{(1S)-1-Hydroxy-2-[(4-methoxybenzyl)oxy]ethyl}-13-methoxy-4,5,6,7-tetrahydro-2-benzoxacycloundecin-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30O6
InChI InChI=1S/C25H30O6/c1-28-20-14-12-18(13-15-20)16-30-17-21(26)22-10-6-4-3-5-8-19-9-7-11-23(29-2)24(19)25(27)31-22/h5,7-9,11-15,21-22,26H,3-4,6,10,16-17H2,1-2H3/b8-5-/t21-,22+/m0/s1
InChIKey RRMZSFNWSPJTET-OFMSAZMGSA-N
Molecular Weight 426.509 g/mol
SMILES O[C@]([C@@]1(OC(c2c(\C=C/CCCC1)cccc2OC)=O)[H])(COCc1ccc(cc1)OC)[H]
SPLASH splash10-00di-0900000000-46305d42fee12bd5ae7e
Source of Spectrum CV-2003-948-20
Wiley ID 1610981