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GIBBEROSENE_D;(4-S*,11-S*,12-R*,13-S*,2-E,7-E,14-Z)-13-ACETOXY-11,12-ACETOXY-11,12-EPOXY-4-HYDROXYCEMBRA-2,7,14-TRIENE
SpectraBase Compound ID BcrGJVbdUuO
InChI InChI=1S/C22H34O4/c1-15(2)18-11-13-21(5,24)12-7-8-16(3)9-10-19-22(6,26-19)20(14-18)25-17(4)23/h8,11,13-15,19-20,24H,7,9-10,12H2,1-6H3/b13-11+,16-8+,18-14+/t19-,20-,21-,22+/m0/s1
InChIKey HVKLCFQGBOCFBB-NMBOOFCZSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Id3XUmg9Pfz
Name GIBBEROSENE_D;(4-S*,11-S*,12-R*,13-S*,2-E,7-E,14-Z)-13-ACETOXY-11,12-ACETOXY-11,12-EPOXY-4-HYDROXYCEMBRA-2,7,14-TRIENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-15(2)18-11-13-21(5,24)12-7-8-16(3)9-10-19-22(6,26-19)20(14-18)25-17(4)23/h8,11,13-15,19-20,24H,7,9-10,12H2,1-6H3/b13-11+,16-8+,18-14+/t19-,20-,21-,22+/m0/s1
InChIKey HVKLCFQGBOCFBB-NMBOOFCZSA-N
Literature Reference Author A.F.AHMED,Z.H.WEN,J.H.SU,Y.T.HSIEH,Y.C.WU,W.P.HU,J.H.SHEU
Literature Reference Citation J.NAT.PROD.,71,179(2008)
Literature Reference DOI 10.1021/np070356p
Molecular Weight 362.510 g/mol
Sample ID 27434
Solvent CDCl3