John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=KkGczE1rb4I SpectraBase Spectrum ID=ItIDhoWxI6q

(accessed ).
TAGALSIN_Q;(5-S*,8-S*,9-S*,10-R*)-13-(S*)-HYDROXY-15,16-DINORLABR-1,4-(18)-DIEN-3-ONE
SpectraBase Compound ID KkGczE1rb4I
InChI InChI=1S/C18H26O2/c1-12-14(19)5-6-15-17(12,3)8-7-13-11-16(2,20)9-10-18(13,15)4/h5-6,13,15,20H,1,7-11H2,2-4H3/t13-,15-,16-,17+,18-/m0/s1
InChIKey IHFRPKCRDFDADJ-FUJDEKNSSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ItIDhoWxI6q
Name TAGALSIN_Q;(5-S*,8-S*,9-S*,10-R*)-13-(S*)-HYDROXY-15,16-DINORLABR-1,4-(18)-DIEN-3-ONE
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-12-14(19)5-6-15-17(12,3)8-7-13-11-16(2,20)9-10-18(13,15)4/h5-6,13,15,20H,1,7-11H2,2-4H3/t13-,15-,16-,17+,18-/m0/s1
InChIKey IHFRPKCRDFDADJ-FUJDEKNSSA-N
Literature Reference Author W.M.HU,M.Y.LI,J.LI,Q.XIAO,G.FENG,J.WU
Literature Reference Citation J.NAT.PROD.,73,1701(2010)
Literature Reference DOI 10.1021/np100484w
Molecular Weight 274.403 g/mol
Sample ID 36064
Solvent CD3OD
SpectraBase Batch ID KGYnl8tCrMI