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PHYSALIN_F;LITERATURE_VALUES
SpectraBase Compound ID Ig2B3KeW0Fl
InChI InChI=1S/C28H30O10/c1-22-10-17-24(3)28-18(22)19(30)27(38-28,34-11-14(22)20(31)35-17)13-9-16-26(36-16)7-4-5-15(29)23(26,2)12(13)6-8-25(28,33)21(32)37-24/h4-5,12-14,16-18,33H,6-11H2,1-3H3/t12-,13?,14-,16+,17+,18-,22+,23-,24-,25-,26+,27+,28-/m0/s1
InChIKey VSLWNSSUMFSGFF-RPDCETJISA-N
Mol Weight 526.54 g/mol
Molecular Formula C28H30O10
Exact Mass 526.183897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5jWjz3IKChu
Name PHYSALIN_F;LITERATURE_VALUES
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O10
InChI InChI=1S/C28H30O10/c1-22-10-17-24(3)28-18(22)19(30)27(38-28,34-11-14(22)20(31)35-17)13-9-16-26(36-16)7-4-5-15(29)23(26,2)12(13)6-8-25(28,33)21(32)37-24/h4-5,12-14,16-18,33H,6-11H2,1-3H3/t12-,13?,14-,16+,17+,18-,22+,23-,24-,25-,26+,27+,28-/m0/s1
InChIKey VSLWNSSUMFSGFF-RPDCETJISA-N
Literature Reference Author N.J.JACOBO-HERRERA,P.BREMNER,N.MARQUEZ,M.P.GUPTA,S.GIBBONS,E .MUNOZ,M.HEINRICH
Literature Reference Citation J.NAT.PROD.,69,328(2006)
Literature Reference DOI 10.1021/np050225t
Molecular Weight 526.540 g/mol
Solvent Unknown
Source File Reference UWMZ18204