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TAGALSIN_T;(5-S*,8-S*,9-S*,10-R*,13-S*)-15-ZETA,16,18-TRIHYDROXYDOLABR-4-(18)-EN-3-ONE
SpectraBase Compound ID INDykAhbCDQ
InChI InChI=1S/C20H32O4/c1-18(17(24)12-22)8-9-19(2)13(10-18)6-7-20(3)14(11-21)15(23)4-5-16(19)20/h11,13,16-17,21-22,24H,4-10,12H2,1-3H3/b14-11+/t13-,16+,17?,18-,19-,20+/m0/s1
InChIKey VEHQOXOBKPFBHP-HLVJOWEYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GIyAZ6jYm8E
Name TAGALSIN_T;(5-S*,8-S*,9-S*,10-R*,13-S*)-15-ZETA,16,18-TRIHYDROXYDOLABR-4-(18)-EN-3-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-18(17(24)12-22)8-9-19(2)13(10-18)6-7-20(3)14(11-21)15(23)4-5-16(19)20/h11,13,16-17,21-22,24H,4-10,12H2,1-3H3/b14-11+/t13-,16+,17?,18-,19-,20+/m0/s1
InChIKey VEHQOXOBKPFBHP-HLVJOWEYSA-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 336.472 g/mol
Sample ID 36067
Solvent CD3OD