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(2,4-CIS/TRANS)-BULLATANOCINONE

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(2,4-CIS/TRANS)-BULLATANOCINONE
SpectraBase Compound ID DUDMzyrAOVp
InChI InChI=1S/2C37H66O8/c2*1-3-4-5-6-7-8-12-15-18-31(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/h2*28-36,39-41H,3-26H2,1-2H3
InChIKey JPXMEYGTWLLHDR-UHFFFAOYSA-N
Mol Weight 1277.9 g/mol
Molecular Formula C74H132O16
Exact Mass 1276.951538 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G15MszAYNak
Name (2,4-CIS/TRANS)-BULLATANOCINONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C74H132O16
InChI InChI=1S/2C37H66O8/c2*1-3-4-5-6-7-8-12-15-18-31(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/h2*28-36,39-41H,3-26H2,1-2H3
InChIKey JPXMEYGTWLLHDR-UHFFFAOYSA-N
Literature Reference Author P.DURET,R.HOCQUEMILLER,A.CAVE
Literature Reference Citation PHYTOCHEM.,48,499(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00033-8
Molecular Weight 1277.852 g/mol
Solvent CDCl3
Source File Reference UWMS1050