Wiley SpectraBase; SpectraBase Compound ID=1PQzBwtUBY SpectraBase Spectrum ID=KXyMBldKyWX
http://spectrabase.com/spectrum/KXyMBldKyWX (accessed Oct 24, 2020).

OLEANOLIC-ACID-3-O-(2',2'-DIMETHYL)-SUCCINATE
SpectraBase Compound ID 1PQzBwtUBY
InChI InChI=1S/C36H56O6/c1-30(2)16-18-36(28(39)40)19-17-34(8)22(23(36)20-30)10-11-25-33(7)14-13-26(42-29(41)31(3,4)21-27(37)38)32(5,6)24(33)12-15-35(25,34)9/h10,23-26H,11-21H2,1-9H3,(H,37,38)(H,39,40)/t23-,24-,25+,26-,33-,34+,35+,36-/m0/s1
InChIKey FNFONEKOKAPVCV-NIWPVQCVSA-N
Mol Weight 584.8 g/mol
Molecular Formula C36H56O6
Exact Mass 584.40769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXyMBldKyWX
SpectraBase Batch ID 655Fq8W20L4
Name OLEANOLIC-ACID-3-O-(2',2'-DIMETHYL)-SUCCINATE
Compound Number 19
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O6
InChI InChI=1S/C36H56O6/c1-30(2)16-18-36(28(39)40)19-17-34(8)22(23(36)20-30)10-11-25-33(7)14-13-26(42-29(41)31(3,4)21-27(37)38)32(5,6)24(33)12-15-35(25,34)9/h10,23-26H,11-21H2,1-9H3,(H,37,38)(H,39,40)/t23-,24-,25+,26-,33-,34+,35+,36-/m0/s1
InChIKey FNFONEKOKAPVCV-NIWPVQCVSA-N
Literature Reference Author Y.KASHIWADA,H.K.WANG,T.NAGAO,S.KITANAKA,I.YASUDA,T.FUJIOKA,T .YAMAGISHI,L.M.COSEN
Literature Reference Citation J.NAT.PROD.,61,1090(1998)
Literature Reference DOI 10.1021/np9800710
Molecular Weight 584.837 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCP2113
SpectraBase Compound ID 1PQzBwtUBY