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3-METHYL-23-OL-6-OXOTINGENOL
SpectraBase Compound ID GAnroMuWvO7
InChI InChI=1S/C29H38O5/c1-16-11-22-26(2,14-21(16)33)7-9-29(5)23-13-19(31)24-17(15-30)25(34-6)20(32)12-18(24)27(23,3)8-10-28(22,29)4/h12-13,16,22,30,32H,7-11,14-15H2,1-6H3/t16-,22-,26+,27+,28+,29-/m1/s1
InChIKey RBLSOESCXXPESG-OVCIZJMLSA-N
Mol Weight 466.6 g/mol
Molecular Formula C29H38O5
Exact Mass 466.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfwFkeQM34t
Name 3-METHYL-23-OL-6-OXOTINGENOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38O5
InChI InChI=1S/C29H38O5/c1-16-11-22-26(2,14-21(16)33)7-9-29(5)23-13-19(31)24-17(15-30)25(34-6)20(32)12-18(24)27(23,3)8-10-28(22,29)4/h12-13,16,22,30,32H,7-11,14-15H2,1-6H3/t16-,22-,26+,27+,28+,29-/m1/s1
InChIKey RBLSOESCXXPESG-OVCIZJMLSA-N
Literature Reference Author Y.TAKAISHI,K.MIYAGI,K.KAWAZOE,K.NAKANO,K.LI,H.DUAN
Literature Reference Citation PHYTOCHEM.,45,975(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00860-6
Molecular Weight 466.618 g/mol
Solvent CDCl3
Source File Reference UWPA1072