John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EsRDzo6uvXA SpectraBase Spectrum ID=1iuyORNP935

(accessed ).
6-BETA-TIGLOYLOXYKOLAVENIC-ACID
SpectraBase Compound ID EsRDzo6uvXA
InChI InChI=1S/C25H38O4/c1-8-17(3)23(28)29-21-15-19(5)24(6,13-12-16(2)14-22(26)27)20-11-9-10-18(4)25(20,21)7/h8,10,14,19-21H,9,11-13,15H2,1-7H3,(H,26,27)/b16-14+,17-8+/t19-,20-,21-,24+,25+/m0/s1
InChIKey XEAOZVIWAIPENF-XIVBTVJISA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iuyORNP935
Name 6-BETA-TIGLOYLOXYKOLAVENIC-ACID
Compound Number 8
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-8-17(3)23(28)29-21-15-19(5)24(6,13-12-16(2)14-22(26)27)20-11-9-10-18(4)25(20,21)7/h8,10,14,19-21H,9,11-13,15H2,1-7H3,(H,26,27)/b16-14+,17-8+/t19-,20-,21-,24+,25+/m0/s1
InChIKey XEAOZVIWAIPENF-XIVBTVJISA-N
Literature Reference Author T.LU,M.A.MENELAOU,D.VARGAS,F.R.FRONCZEK,N.H.FISCHER
Literature Reference Citation PHYTOCHEM.,32,1483(1993)
Literature Reference DOI 10.1016/0031-9422(93)85163-L
Molecular Weight 402.574 g/mol
Solvent CDCl3
Source File Reference UWLU6585
SpectraBase Batch ID 22NsQqZNkDq