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(-)-(23-E)-TIRUCALLA-8,23-DIEN-3-BETA,25-DIOL-7-ONE

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(-)-(23-E)-TIRUCALLA-8,23-DIEN-3-BETA,25-DIOL-7-ONE
SpectraBase Compound ID BMg8kKj7xOt
InChI InChI=1S/C30H48O3/c1-19(10-9-14-26(2,3)33)20-11-17-30(8)25-21(12-16-29(20,30)7)28(6)15-13-24(32)27(4,5)23(28)18-22(25)31/h9,14,19-20,23-24,32-33H,10-13,15-18H2,1-8H3/b14-9+/t19-,20-,23?,24-,28+,29-,30+/m0/s1
InChIKey HGMDURCSONKDEI-SYIDWMRWSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqGFuDFpX3y
Name (-)-(23-E)-TIRUCALLA-8,23-DIEN-3-BETA,25-DIOL-7-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-19(10-9-14-26(2,3)33)20-11-17-30(8)25-21(12-16-29(20,30)7)28(6)15-13-24(32)27(4,5)23(28)18-22(25)31/h9,14,19-20,23-24,32-33H,10-13,15-18H2,1-8H3/b14-9+/t19-,20-,23?,24-,28+,29-,30+/m0/s1
InChIKey HGMDURCSONKDEI-SYIDWMRWSA-N
Literature Reference Author W.XU,C.ZHU,W.CHENG,X.FAN,X.CHEN,S.YANG,Y.GUO,F.YE,J.SHI
Literature Reference Citation J.NAT.PROD.,72,1620(2009)
Literature Reference DOI 10.1021/np900305j
Molecular Weight 456.709 g/mol
Sample ID 33515
Solvent ACETONE-D6