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3-BETA,16-BETA-DIHYDROXY-6-OXO-LUP-20(29)-ENE
SpectraBase Compound ID 3vXwWzHRs9J
InChI InChI=1S/C30H48O3/c1-17(2)18-11-13-28(6)23(33)16-29(7)19(24(18)28)9-10-21-27(5)14-12-22(32)26(3,4)25(27)20(31)15-30(21,29)8/h18-19,21-25,32-33H,1,9-16H2,2-8H3/t18-,19+,21+,22-,23-,24+,25-,27+,28+,29+,30+/m0/s1
InChIKey HGKYIYMVNYICPZ-DFSPYCNGSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cmn2a267FAY
Name 3-BETA,16-BETA-DIHYDROXY-6-OXO-LUP-20(29)-ENE
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-17(2)18-11-13-28(6)23(33)16-29(7)19(24(18)28)9-10-21-27(5)14-12-22(32)26(3,4)25(27)20(31)15-30(21,29)8/h18-19,21-25,32-33H,1,9-16H2,2-8H3/t18-,19+,21+,22-,23-,24+,25-,27+,28+,29+,30+/m0/s1
InChIKey HGKYIYMVNYICPZ-DFSPYCNGSA-N
Literature Reference Author V.A.FACUNDO,C.H.S.ANDRADE,E.R.SILVEIRA,R.BRAZ-FILHO,C.D.HUFF ORD
Literature Reference Citation PHYTOCHEM.,32,411(1993)
Literature Reference DOI 10.1016/S0031-9422(00)95005-2
Molecular Weight 456.709 g/mol
Solvent C5D5N
Source File Reference UWMS4521