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12-O-ACETYL-3-O-BENZOYL-2EPI-INGOL_8-TIGLATE
SpectraBase Compound ID GtuCLrZ8gLi
InChI InChI=1S/C34H42O9/c1-9-17(2)30(38)41-27-24-23(32(24,7)8)26(40-21(6)35)20(5)28(37)33-16-19(4)29(34(33,43-33)15-18(3)25(27)36)42-31(39)22-13-11-10-12-14-22/h9-15,19-20,23-27,29,36H,16H2,1-8H3/b17-9+,18-15+/t19-,20-,23+,24-,25-,26-,27+,29+,33+,34+/m1/s1
InChIKey FYGIUALPJJOYCO-OFBPKHAKSA-N
Mol Weight 594.7 g/mol
Molecular Formula C34H42O9
Exact Mass 594.282883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3pLIgdeBADL
Name 12-O-ACETYL-3-O-BENZOYL-2EPI-INGOL_8-TIGLATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H42O9
InChI InChI=1S/C34H42O9/c1-9-17(2)30(38)41-27-24-23(32(24,7)8)26(40-21(6)35)20(5)28(37)33-16-19(4)29(34(33,43-33)15-18(3)25(27)36)42-31(39)22-13-11-10-12-14-22/h9-15,19-20,23-27,29,36H,16H2,1-8H3/b17-9+,18-15+/t19-,20-,23+,24-,25-,26-,27+,29+,33+,34+/m1/s1
InChIKey FYGIUALPJJOYCO-OFBPKHAKSA-N
Literature Reference Author X.L.LI,Y.LI,S.F.WANG,Y.L.ZHAO,K.C.LIU,X.M.WANG,Y.P.YANG
Literature Reference Citation J.NAT.PROD.,72,1001(2009)
Literature Reference DOI 10.1021/np800816n
Molecular Weight 594.702 g/mol
Sample ID 32693
Solvent CDCl3