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Ligustenin A
SpectraBase Compound ID KsLblJXHRyu
InChI InChI=1S/C26H28O8/c1-15(18-8-16-9-21(30-5)22(31-6)12-20(16)33-18)13-26(2,3)25(28)34-24-10-17(14-27)19(29-4)11-23(24)32-7/h8-12,14H,1,13H2,2-7H3
InChIKey WDUBFWKWGJXUPQ-UHFFFAOYSA-N
Mol Weight 468.5 g/mol
Molecular Formula C26H28O8
Exact Mass 468.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhugRuAM8U0
Name Ligustenin A
Alternate Name(s) 5-formyl-2,4-dimethoxyphenyl 4-(5,6-dimethoxybenzofuran-2-yl)-2,2-dimethylpent-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O8
InChI InChI=1S/C26H28O8/c1-15(18-8-16-9-21(30-5)22(31-6)12-20(16)33-18)13-26(2,3)25(28)34-24-10-17(14-27)19(29-4)11-23(24)32-7/h8-12,14H,1,13H2,2-7H3
InChIKey WDUBFWKWGJXUPQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200400130
Molecular Weight 468.502 g/mol
SMILES c1(OC)c(OC)cc2cc(C(CC(C)(C)C(=O)Oc3c(OC)cc(OC)c(C=O)c3)=C)oc2c1
SPLASH splash10-0gbi-0190000000-e082ef4bc440f31064f6
Source of Spectrum QA-51-867-1
Wiley ID 1795960