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(+)-BOEHMENAN_X

View entire compound with spectra: 1 NMR

(+)-BOEHMENAN_X
SpectraBase Compound ID 3611DGTwHjM
InChI InChI=1S/C39H38O11/c1-45-33-20-25(8-14-31(33)41)10-17-36(43)48-18-4-5-26-19-29-30(23-49-37(44)16-9-24-6-12-28(40)13-7-24)38(50-39(29)35(21-26)47-3)27-11-15-32(42)34(22-27)46-2/h6-17,19-22,30,38,40-42H,4-5,18,23H2,1-3H3/b16-9+,17-10+/t30-,38+/m1/s1
InChIKey KXKFYMOZFCYESW-PSQUMQRJSA-N
Mol Weight 682.7 g/mol
Molecular Formula C39H38O11
Exact Mass 682.241412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2stI2APjo43
Name (+)-BOEHMENAN_X
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H38O11
InChI InChI=1S/C39H38O11/c1-45-33-20-25(8-14-31(33)41)10-17-36(43)48-18-4-5-26-19-29-30(23-49-37(44)16-9-24-6-12-28(40)13-7-24)38(50-39(29)35(21-26)47-3)27-11-15-32(42)34(22-27)46-2/h6-17,19-22,30,38,40-42H,4-5,18,23H2,1-3H3/b16-9+,17-10+/t30-,38+/m1/s1
InChIKey KXKFYMOZFCYESW-PSQUMQRJSA-N
Literature Reference Author X.RUDIYANSYAH,L.K.LAMBERT,M.J.GARSON
Literature Reference Citation J.NAT.PROD.,73,1649(2010)
Literature Reference DOI 10.1021/np100332v
Molecular Weight 682.724 g/mol
Sample ID 36167
Solvent CD3OD