John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7YEqumlWEe SpectraBase Spectrum ID=2bnsqmtwvZQ

(accessed ).
2-BETA-HYDROXY-23-(2-ISOPROPANOLOXY)-OLEANOLIC-ACID
SpectraBase Compound ID 7YEqumlWEe
InChI InChI=1S/C33H54O6/c1-27(2)13-15-33(26(36)37)16-14-31(7)20(21(33)17-27)9-10-24-29(5)18-22(34)25(35)30(6,19-39-28(3,4)38)23(29)11-12-32(24,31)8/h9,21-25,34-35,38H,10-19H2,1-8H3,(H,36,37)/t21-,22-,23+,24+,25-,29-,30-,31+,32+,33-/m0/s1
InChIKey IVNOKFWKEOGTPG-UBAKGTNGSA-N
Mol Weight 546.8 g/mol
Molecular Formula C33H54O6
Exact Mass 546.39204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bnsqmtwvZQ
Name 2-BETA-HYDROXY-23-(2-ISOPROPANOLOXY)-OLEANOLIC-ACID
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H54O6
InChI InChI=1S/C33H54O6/c1-27(2)13-15-33(26(36)37)16-14-31(7)20(21(33)17-27)9-10-24-29(5)18-22(34)25(35)30(6,19-39-28(3,4)38)23(29)11-12-32(24,31)8/h9,21-25,34-35,38H,10-19H2,1-8H3,(H,36,37)/t21-,22-,23+,24+,25-,29-,30-,31+,32+,33-/m0/s1
InChIKey IVNOKFWKEOGTPG-UBAKGTNGSA-N
Literature Reference Author X.L.ZHOU,C.J.XIAO,L.B.WU,B.HUANG,X.DONG,B.JIANG
Literature Reference Citation J.AS.NAT.PROD.RES.,16,555(2014)
Literature Reference DOI 10.1080/10286020.2014.918110
Molecular Weight 546.788 g/mol
Solvent CDCl3
Source File Reference UWPA9159
SpectraBase Batch ID 41oKHU05h6I