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METHYL-3,15,16-TRIKETO-OLEAN-12-ENE-28-OATE
SpectraBase Compound ID 6FNxTsC4X8D
InChI InChI=1S/C31H44O5/c1-26(2)15-16-31(25(35)36-8)19(17-26)18-9-10-21-28(5)13-12-22(32)27(3,4)20(28)11-14-29(21,6)30(18,7)23(33)24(31)34/h9,19-21H,10-17H2,1-8H3/t19-,20?,21+,28-,29+,30-,31+/m0/s1
InChIKey WYYPSCASCBQCGS-IVVJPZKVSA-N
Mol Weight 496.7 g/mol
Molecular Formula C31H44O5
Exact Mass 496.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KSzJMpZB51T
Name METHYL-3,15,16-TRIKETO-OLEAN-12-ENE-28-OATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H44O5
InChI InChI=1S/C31H44O5/c1-26(2)15-16-31(25(35)36-8)19(17-26)18-9-10-21-28(5)13-12-22(32)27(3,4)20(28)11-14-29(21,6)30(18,7)23(33)24(31)34/h9,19-21H,10-17H2,1-8H3/t19-,20?,21+,28-,29+,30-,31+/m0/s1
InChIKey WYYPSCASCBQCGS-IVVJPZKVSA-N
Literature Reference Author A.PATRA,A.K.MITRA,S.GHOSH,A.GHOSH,A.K.BARUA
Literature Reference Citation ORG.MAGN.RES.,15,399(1981)
Literature Reference DOI 10.1002/mrc.1270150415
Molecular Weight 496.687 g/mol
Solvent CDCl3
Source File Reference UNIW1641