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3-BETA,6-ALPHA,7-ALPHA,19-TETRAACETOXY-4-ALPHA,18:7-BETA,10-BETA:15,16-TRIEPOXY-NEO-CLERODA-13(16),14-DIEN
SpectraBase Compound ID 4ZNGBDnciZ7
InChI InChI=1S/C28H36O11/c1-16-24(6,10-7-21-9-12-33-13-21)27-11-8-22(36-18(3)30)26(15-35-26)25(27,14-34-17(2)29)23(37-19(4)31)28(16,39-27)38-20(5)32/h9,12-13,16,22-23H,7-8,10-11,14-15H2,1-6H3/t16-,22-,23+,24-,25-,26+,27-,28+/m0/s1
InChIKey OXLQXFUAQRUWQF-XZXPTGNPSA-N
Mol Weight 548.6 g/mol
Molecular Formula C28H36O11
Exact Mass 548.225762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DtINdHWqDNS
Name 3-BETA,6-ALPHA,7-ALPHA,19-TETRAACETOXY-4-ALPHA,18:7-BETA,10-BETA:15,16-TRIEPOXY-NEO-CLERODA-13(16),14-DIEN
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O11
InChI InChI=1S/C28H36O11/c1-16-24(6,10-7-21-9-12-33-13-21)27-11-8-22(36-18(3)30)26(15-35-26)25(27,14-34-17(2)29)23(37-19(4)31)28(16,39-27)38-20(5)32/h9,12-13,16,22-23H,7-8,10-11,14-15H2,1-6H3/t16-,22-,23+,24-,25-,26+,27-,28+/m0/s1
InChIKey OXLQXFUAQRUWQF-XZXPTGNPSA-N
Literature Reference Author M.BRUNO,A.A.OMAR,A.PERALES,F.PIOZZI,B.RODRIGUEZ,G.SAVONA,M.C .D.L.TORRE
Literature Reference Citation PHYTOCHEM.,30,275(1991)
Literature Reference DOI 10.1016/0031-9422(91)84137-H
Molecular Weight 548.587 g/mol
Solvent CDCl3
Source File Reference UWKP6588