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Betulic acid, methyl ester
SpectraBase Compound ID 4VqePifUZb7
InChI InChI=1S/C31H50O3/c1-19(2)20-11-16-31(26(33)34-8)18-17-29(6)21(25(20)31)9-10-23-28(5)14-13-24(32)27(3,4)22(28)12-15-30(23,29)7/h20-25,32H,1,9-18H2,2-8H3
InChIKey XNZIMRUZBOZIBC-UHFFFAOYSA-N
Mol Weight 470.7 g/mol
Molecular Formula C31H50O3
Exact Mass 470.375995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XgM2GHyPbN
Name Betulic acid, methyl ester
CAS Registry Number 2259-06-5
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Formula C31H50O3
InChI InChI=1S/C31H50O3/c1-19(2)20-11-16-31(26(33)34-8)18-17-29(6)21(25(20)31)9-10-23-28(5)14-13-24(32)27(3,4)22(28)12-15-30(23,29)7/h20-25,32H,1,9-18H2,2-8H3
InChIKey XNZIMRUZBOZIBC-UHFFFAOYSA-N
Literature Reference J. Nat. Products 47, 673 (1984).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3