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3-BETA-HYDROXY-LUP-20(29)-EN-28-OIC-ACID-3'-(MORPHOLIN-4''-YL)-PROPYLESTER
SpectraBase Compound ID BteTNrcRDkb
InChI InChI=1S/C37H61NO4/c1-25(2)26-11-16-37(32(40)42-22-8-19-38-20-23-41-24-21-38)18-17-35(6)27(31(26)37)9-10-29-34(5)14-13-30(39)33(3,4)28(34)12-15-36(29,35)7/h26-31,39H,1,8-24H2,2-7H3/t26-,27+,28-,29+,30-,31+,34-,35+,36+,37-/m0/s1
InChIKey AQBURASCHVNJAN-LYOFKBFXSA-N
Mol Weight 583.9 g/mol
Molecular Formula C37H61NO4
Exact Mass 583.460059 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRhxgtG5ZVb
Name 3-BETA-HYDROXY-LUP-20(29)-EN-28-OIC-ACID-3'-(MORPHOLIN-4''-YL)-PROPYLESTER
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H61NO4
InChI InChI=1S/C37H61NO4/c1-25(2)26-11-16-37(32(40)42-22-8-19-38-20-23-41-24-21-38)18-17-35(6)27(31(26)37)9-10-29-34(5)14-13-30(39)33(3,4)28(34)12-15-36(29,35)7/h26-31,39H,1,8-24H2,2-7H3/t26-,27+,28-,29+,30-,31+,34-,35+,36+,37-/m0/s1
InChIKey AQBURASCHVNJAN-LYOFKBFXSA-N
Literature Reference Author S.YANG,N.LIANG,H.LI,W.XUE,D.HU,L.JIN,Q.ZHAO,S.YANG
Literature Reference Citation CHEM.CENTR.J.,6,141,1(2012)
Molecular Weight 583.896 g/mol
Solvent CDCl3
Source File Reference UWIR11728