John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1SRCzD1YqR7 SpectraBase Spectrum ID=2vi2GJZjeen

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GAMBOGIC-ACID
SpectraBase Compound ID 1SRCzD1YqR7
InChI InChI=1S/C38H44O8/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-36)12-11-21(3)4/h10-11,13-14,16,18,23,27,39H,9,12,15,17,19H2,1-8H3,(H,42,43)/b22-13+/t23-,27+,36?,37+,38-/m0/s1
InChIKey GEZHEQNLKAOMCA-KLUFLYOESA-N
Mol Weight 628.8 g/mol
Molecular Formula C38H44O8
Exact Mass 628.303619 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2vi2GJZjeen
Name ISO-GAMBOGIC-ACID
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H44O8
InChI InChI=1S/C38H44O8/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-36)12-11-21(3)4/h10-11,13-14,16,18,23,27,39H,9,12,15,17,19H2,1-8H3,(H,42,43)/b22-13+/t23-,27+,36?,37+,38-/m0/s1
InChIKey GEZHEQNLKAOMCA-KLUFLYOESA-N
Literature Reference Author L.J.LIN,L.Z.LIN,J.M.PEZZUTO,G.A.CORDELL,N.RUANGRUNGSI
Literature Reference Citation MAGN.RES.CHEM.,31,340(1993)
Literature Reference DOI 10.1002/mrc.1260310406
Molecular Weight 628.763 g/mol
Solvent CDCl3
Source File Reference UWMR196
SpectraBase Batch ID 3bP50tsYhas