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(+)-(2Z,11Z,4S,5S,9S,10S)-5,9-DIHYDROXY-4,10-DIMETHYL-7-METHYLIDENE-TRIDECA-2,11-DIENE-3,11-DIYL-DIBENZOATE
SpectraBase Compound ID 8vQmsUhaj3F
InChI InChI=1S/C30H36O6/c1-6-27(35-29(33)23-14-10-8-11-15-23)21(4)25(31)18-20(3)19-26(32)22(5)28(7-2)36-30(34)24-16-12-9-13-17-24/h6-17,21-22,25-26,31-32H,3,18-19H2,1-2,4-5H3/b27-6-,28-7+/t21-,22-,25-,26-/m1/s1
InChIKey SWRGUZWLHKPNJL-HPXWARKQSA-N
Mol Weight 492.6 g/mol
Molecular Formula C30H36O6
Exact Mass 492.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JofVCu9wgg4
Name (+)-(2Z,11Z,4S,5S,9S,10S)-5,9-DIHYDROXY-4,10-DIMETHYL-7-METHYLIDENE-TRIDECA-2,11-DIENE-3,11-DIYL-DIBENZOATE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H36O6
InChI InChI=1S/C30H36O6/c1-6-27(35-29(33)23-14-10-8-11-15-23)21(4)25(31)18-20(3)19-26(32)22(5)28(7-2)36-30(34)24-16-12-9-13-17-24/h6-17,21-22,25-26,31-32H,3,18-19H2,1-2,4-5H3/b27-6-,28-7+/t21-,22-,25-,26-/m1/s1
InChIKey SWRGUZWLHKPNJL-HPXWARKQSA-N
Literature Reference Author M.TURKS,F.FONQUERNE,P.VOGEL
Literature Reference Citation ORG.LETTERS,6,1053(2004)
Literature Reference DOI 10.1021/ol0498646
Molecular Weight 492.612 g/mol
Sample ID 50212
Solvent CDCl3