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CALODENIN B
SpectraBase Compound ID JJQBT92u1B3
InChI InChI=1S/C30H20O9/c31-17-6-1-15(2-7-17)3-12-21(34)25-23(36)14-24(37)26-27(28(38)20-11-10-19(33)13-22(20)35)29(39-30(25)26)16-4-8-18(32)9-5-16/h1-14,31-33,35-37H/b12-3+
InChIKey OYSSHUWICGHBOU-KGVSQERTSA-N
Mol Weight 524.48 g/mol
Molecular Formula C30H20O9
Exact Mass 524.110732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4V5iGytMiHA
Name CALODENIN-B
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H20O9
InChI InChI=1S/C30H20O9/c31-17-6-1-15(2-7-17)3-12-21(34)25-23(36)14-24(37)26-27(28(38)20-11-10-19(33)13-22(20)35)29(39-30(25)26)16-4-8-18(32)9-5-16/h1-14,31-33,35-37H/b12-3+
InChIKey OYSSHUWICGHBOU-KGVSQERTSA-N
Literature Reference Author B.MESSANGA,R.G.TIH,B.L.SONDENGAM,M.T.MARTIN,B.BODO
Literature Reference Citation PHYTOCHEM.,35,791(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90607-1
Molecular Weight 524.483 g/mol
Solvent ACETONE-D6
Source File Reference UWLU25162