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AURICULASIN
SpectraBase Compound ID HKOpAYqAGUp
InChI InChI=1S/C25H24O6/c1-13(2)5-7-16-23-15(9-10-25(3,4)31-23)21(28)20-22(29)17(12-30-24(16)20)14-6-8-18(26)19(27)11-14/h5-6,8-12,26-28H,7H2,1-4H3
InChIKey PSEBCAMYGWGJMH-UHFFFAOYSA-N
Mol Weight 420.46 g/mol
Molecular Formula C25H24O6
Exact Mass 420.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrDBIXeGkvm
Name 3-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)pyrano[3,2-g]chromen-4(8H)-one
Alternate Name(s) 7-(3,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-en-1-yl)-2H,6H-pyrano[3,2-g]chromen-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O6
InChI InChI=1S/C25H24O6/c1-13(2)5-7-16-23-15(9-10-25(3,4)31-23)21(28)20-22(29)17(12-30-24(16)20)14-6-8-18(26)19(27)11-14/h5-6,8-12,26-28H,7H2,1-4H3
InChIKey PSEBCAMYGWGJMH-UHFFFAOYSA-N
Molecular Weight 420.461 g/mol
SMILES Oc1cc(ccc1O)C=1C(c2c(c3c(c(c2OC1)CC=C(C)C)OC(C=C3)(C)C)O)=O
SPLASH splash10-0avi-1427900000-f3c00c7a523b27c7e3c3
Source of Spectrum Yan Wang, et al. Bioorganic & Medicinal Chemistry, V. 21, 2013, P.6398-6404
Wiley ID 1817408