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8,14-DIBENZOYL-BIKHACONINE

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8,14-DIBENZOYL-BIKHACONINE
SpectraBase Compound ID 55fYKuByifC
InChI InChI=1S/C39H49NO9/c1-6-40-21-36(22-44-2)18-17-26(45-3)39-25-19-37(43)27(46-4)20-38(29(32(39)40)30(47-5)31(36)39,49-35(42)24-15-11-8-12-16-24)28(25)33(37)48-34(41)23-13-9-7-10-14-23/h7-16,25-33,43H,6,17-22H2,1-5H3/t25-,26+,27+,28-,29+,30+,31-,32-,33-,36-,37+,38-,39+/m1/s1
InChIKey SRZCTAAONDHELV-IDPCURIBSA-N
Mol Weight 675.8 g/mol
Molecular Formula C39H49NO9
Exact Mass 675.340732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxbmnIvczp4
Name 8,14-DIBENZOYL-BIKHACONINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H49NO9
InChI InChI=1S/C39H49NO9/c1-6-40-21-36(22-44-2)18-17-26(45-3)39-25-19-37(43)27(46-4)20-38(29(32(39)40)30(47-5)31(36)39,49-35(42)24-15-11-8-12-16-24)28(25)33(37)48-34(41)23-13-9-7-10-14-23/h7-16,25-33,43H,6,17-22H2,1-5H3/t25-,26+,27+,28-,29+,30+,31-,32-,33-,36-,37+,38-,39+/m1/s1
InChIKey SRZCTAAONDHELV-IDPCURIBSA-N
Literature Reference Author J.L.WANG,X.L.SHEN,Q.H.CHEN,G.QI,W.WANG,G.QI,W.WANG,F.P.WANG
Literature Reference Citation CHEM.PHARM.BULL.,57,801(2009)
Literature Reference DOI 10.1248/cpb.57.801
Molecular Weight 675.819 g/mol
Sample ID 2820
Solvent CDCl3