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Glaucarubinone tetraacetate
SpectraBase Compound ID Je3n2scPjU5
InChI InChI=1S/C33H42O14/c1-10-31(8,47-19(7)37)30(41)46-26-23-15(3)25(43-17(5)35)24(39)27-32(9)20(14(2)11-21(38)28(32)44-18(6)36)12-22(45-29(26)40)33(23,27)13-42-16(4)34/h11,15,20,22-23,25-28H,10,12-13H2,1-9H3/t15-,20+,22-,23-,25-,26-,27-,28-,31?,32+,33+/m1/s1
InChIKey MBRVWCPHUSNLDU-DHLWZXAWSA-N
Mol Weight 662.7 g/mol
Molecular Formula C33H42O14
Exact Mass 662.257456 g/mol
Enantiomer InChIKey MBRVWCPHUSNLDU-VYTMRBBPSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Title Journal or Book Year
Carbon-13 nuclear magnetic resonance spectroscopy of naturally occurring substances. XXXI. Carbon-13 nuclear magnetic resonance spectral analysis of quassinoid bitter principles The Journal of Organic Chemistry 1975

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