John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=27wMKgvzh2k SpectraBase Spectrum ID=1kLryhmWrDq

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TRANS-BULLATALICINONE
SpectraBase Compound ID 27wMKgvzh2k
InChI InChI=1S/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-29(43-34)16-13-10-9-11-14-17-30-26-28(25-27(2)38)37(42)44-30/h28-36,39-41H,3-26H2,1-2H3
InChIKey WAZNHZWSJGMXPS-UHFFFAOYSA-N
Mol Weight 638.9 g/mol
Molecular Formula C37H66O8
Exact Mass 638.47577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kLryhmWrDq
Name TRANS-BULLATALICINONE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H66O8
InChI InChI=1S/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-29(43-34)16-13-10-9-11-14-17-30-26-28(25-27(2)38)37(42)44-30/h28-36,39-41H,3-26H2,1-2H3
InChIKey WAZNHZWSJGMXPS-UHFFFAOYSA-N
Literature Reference Author X.P.FANG,Z.M.GU,M.J.RIESER,Y.H.HUI,J.L.MCLAUGHLIN,M.NONFON,F .LIEB,H.F.MOESCHLER,
Literature Reference Citation J.NAT.PROD.,56,1095(1993)
Literature Reference DOI 10.1021/np50097a013
Molecular Weight 638.926 g/mol
Solvent CDCl3
Source File Reference UWTS213
SpectraBase Batch ID B8rwFhcY8Rm