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3-KETO-16-ALPHA-HYDROXY-24-NOROLEANOLIC-ACID
SpectraBase Compound ID 2Lt7rDmzCKy
InChI InChI=1S/C29H44O4/c1-17-18-9-12-27(5)22(26(18,4)11-10-21(17)30)8-7-19-20-15-25(2,3)13-14-29(20,24(32)33)23(31)16-28(19,27)6/h7,17-18,20,22-23,31H,8-16H2,1-6H3,(H,32,33)/t17-,18?,20?,22?,23-,26+,27-,28-,29-/m1/s1
InChIKey RVBCCBBWGJZXNN-KIZMAOSYSA-N
Mol Weight 456.7 g/mol
Molecular Formula C29H44O4
Exact Mass 456.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HeKMkLT14g3
Name 3-KETO-16-ALPHA-HYDROXY-24-NOROLEANOLIC-ACID
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H44O4
InChI InChI=1S/C29H44O4/c1-17-18-9-12-27(5)22(26(18,4)11-10-21(17)30)8-7-19-20-15-25(2,3)13-14-29(20,24(32)33)23(31)16-28(19,27)6/h7,17-18,20,22-23,31H,8-16H2,1-6H3,(H,32,33)/t17-,18?,20?,22?,23-,26+,27-,28-,29-/m1/s1
InChIKey RVBCCBBWGJZXNN-KIZMAOSYSA-N
Literature Reference Author Z.JIA,K.KOIKE,M.KUDO,H.LI,T.NIKAIDO
Literature Reference Citation PHYTOCHEM.,48,529(1998)
Literature Reference DOI 10.1016/S0031-9422(97)01128-X
Molecular Weight 456.666 g/mol
Solvent C5D5N
Source File Reference UWMS1075