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1-Ethoxy-3,8-dihydroxy-2-[3-keto-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-6-methoxy-9,10-anthraquinone
SpectraBase Compound ID D6iomK5ptbf
InChI InChI=1S/C25H26O9/c1-4-32-24-15(6-5-13(26)12-25(2)33-7-8-34-25)18(27)11-17-21(24)23(30)20-16(22(17)29)9-14(31-3)10-19(20)28/h9-11,27-28H,4-8,12H2,1-3H3
InChIKey ZMVZYKRXQGBGLR-UHFFFAOYSA-N
Mol Weight 470.47 g/mol
Molecular Formula C25H26O9
Exact Mass 470.157682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMNd5CGnJdM
Name 1-Ethoxy-3,8-dihydroxy-2-[3-keto-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-6-methoxy-9,10-anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O9
InChI InChI=1S/C25H26O9/c1-4-32-24-15(6-5-13(26)12-25(2)33-7-8-34-25)18(27)11-17-21(24)23(30)20-16(22(17)29)9-14(31-3)10-19(20)28/h9-11,27-28H,4-8,12H2,1-3H3
InChIKey ZMVZYKRXQGBGLR-UHFFFAOYSA-N
Molecular Weight 470.474 g/mol
SMILES Oc1cc2c(C(c3c(cc(cc3C2=O)OC)O)=O)c(c1CCC(CC1(OCCO1)C)=O)OCC
SPLASH splash10-000i-9000000000-dda27263215563653082
Source of Spectrum U1-1999-3101-11
Synonyms 1-Ethoxy-3,8-dihydroxy-6-methoxy-2-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-butyl]anthracene-9,10-dione 1-Ethoxy-6-methoxy-2-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-butyl]-3,8-bis(oxidanyl)anthracene-9,10-dione
Wiley ID 753391