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(3S,4R,5S)-5-[7-methoxy-6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]-3,4-dimethyl-2-oxolanone
SpectraBase Compound ID 8ZtLoghUF6H
InChI InChI=1S/C23H26O8/c1-11-12(2)23(24)31-19(11)14-9-17-21(30-10-29-17)22(28-6)18(14)13-7-15(25-3)20(27-5)16(8-13)26-4/h7-9,11-12,19H,10H2,1-6H3/t11-,12+,19+/m1/s1
InChIKey YGJWBZGKXSGXHD-UFYHVXEKSA-N
Mol Weight 430.45 g/mol
Molecular Formula C23H26O8
Exact Mass 430.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PTV0whupLI
Name (3S,4R,5S)-5-[7-methoxy-6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]-3,4-dimethyl-2-oxolanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O8
InChI InChI=1S/C23H26O8/c1-11-12(2)23(24)31-19(11)14-9-17-21(30-10-29-17)22(28-6)18(14)13-7-15(25-3)20(27-5)16(8-13)26-4/h7-9,11-12,19H,10H2,1-6H3/t11-,12+,19+/m1/s1
InChIKey YGJWBZGKXSGXHD-UFYHVXEKSA-N
Molecular Weight 430.453 g/mol
SMILES [C@@]1(c2c(c(OC)c3c(c2)OCO3)-c2cc(OC)c(c(c2)OC)OC)(OC(=O)[C@]([C@]1(C)[H])(C)[H])[H]
SPLASH splash10-001i-4203900000-5627079fc99b37bb2181
Source of Spectrum B-44-1713-4
Synonyms (3S,4R,5S)-5-[7-methoxy-6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]-3,4-dimethyl-oxolan-2-one (3S,4R,5S)-5-[7-methoxy-6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]-3,4-dimethyl-tetrahydrofuran-2-one
Wiley ID 1381506