John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7NTIzR1rE4j SpectraBase Spectrum ID=3lvp5dGafe4

(accessed ).
(+)-(4->2)-ABEO-KOLAVELOOL-3-OIC-ACID;(5R,8R,9S,10R)-(4->2)-ABEO-CLEROD-13-BETA-HYDROXY-2,14-DIEN-3-OIC-ACID
SpectraBase Compound ID 7NTIzR1rE4j
InChI InChI=1S/C20H32O3/c1-7-18(4,23)10-11-19(5)13(2)8-9-20(6)14(3)15(17(21)22)12-16(19)20/h7,13,16,23H,1,8-12H2,2-6H3,(H,21,22)/t13-,16-,18-,19+,20+/m1/s1
InChIKey SOBYMLTWZSESRW-GQJWIHHCSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3lvp5dGafe4
Name (+)-(4->2)-ABEO-KOLAVELOOL-3-OIC-ACID;(5R,8R,9S,10R)-(4->2)-ABEO-CLEROD-13-BETA-HYDROXY-2,14-DIEN-3-OIC-ACID
Compound Number 39
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-7-18(4,23)10-11-19(5)13(2)8-9-20(6)14(3)15(17(21)22)12-16(19)20/h7,13,16,23H,1,8-12H2,2-6H3,(H,21,22)/t13-,16-,18-,19+,20+/m1/s1
InChIKey SOBYMLTWZSESRW-GQJWIHHCSA-N
Literature Reference Author A.G.PACHECO,P.M.DEOLIVEIRA,D.PILO-VELOSO,A.F.D.C.ALCANTARA
Literature Reference Citation MOLECULES,14,1245(2009)
Literature Reference DOI 10.3390/molecules14031245
Molecular Weight 320.472 g/mol
Sample ID 69404
Solvent CDCl3
SpectraBase Batch ID 2LF9aZ7x2Nu