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PSEUDOPTEROSIN-W-2'-ACETATE
SpectraBase Compound ID 6QCQIJpNzCI
InChI InChI=1S/C31H42O9/c1-14(2)11-21-12-16(4)22-10-9-15(3)24-26(22)25(21)17(5)28(27(24)35)40-31-30(39-20(8)34)29(38-19(7)33)23(13-36-31)37-18(6)32/h11,15-16,21-23,29-31,35H,9-10,12-13H2,1-8H3/t15-,16-,21+,22+,23-,29-,30+,31-/m1/s1
InChIKey WPWDYWFKJLDOHN-DZRHJHPRSA-N
Mol Weight 558.7 g/mol
Molecular Formula C31H42O9
Exact Mass 558.282883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oba7jr3lvs
Name PSEUDOPTEROSIN-W-2'-ACETATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H42O9
InChI InChI=1S/C31H42O9/c1-14(2)11-21-12-16(4)22-10-9-15(3)24-26(22)25(21)17(5)28(27(24)35)40-31-30(39-20(8)34)29(38-19(7)33)23(13-36-31)37-18(6)32/h11,15-16,21-23,29-31,35H,9-10,12-13H2,1-8H3/t15-,16-,21+,22+,23-,29-,30+,31-/m1/s1
InChIKey WPWDYWFKJLDOHN-DZRHJHPRSA-N
Literature Reference Author I.I.RODRIGUEZ,Y.P.SHI,O.J.GARCIA,A.D.RODRIGUEZ,A.M.S.MAYER,J .A.SANCHEZ,E.ORTEGA-
Literature Reference Citation J.NAT.PROD.,67,1672(2004)
Literature Reference DOI 10.1021/np049802o
Molecular Weight 558.669 g/mol
Solvent CDCl3
Source File Reference UWMZ6536