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LUPANE-3-BETA,16-BETA,20-TRIOL_3-MYRISTATE
SpectraBase Compound ID 5mUgZfdQCXD
InChI InChI=1S/C44H78O4/c1-10-11-12-13-14-15-16-17-18-19-20-21-37(46)48-36-26-28-41(6)33(39(36,2)3)25-29-43(8)34(41)23-22-32-38-31(40(4,5)47)24-27-42(38,7)35(45)30-44(32,43)9/h31-36,38,45,47H,10-30H2,1-9H3
InChIKey WWMFNEDCFMWTHA-UHFFFAOYSA-N
Mol Weight 671.1 g/mol
Molecular Formula C44H78O4
Exact Mass 670.590011 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J1vii8Q4CkI
Name LUPANE-3-BETA,16-BETA,20-TRIOL_3-MYRISTATE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H78O4
InChI InChI=1S/C44H78O4/c1-10-11-12-13-14-15-16-17-18-19-20-21-37(46)48-36-26-28-41(6)33(39(36,2)3)25-29-43(8)34(41)23-22-32-38-31(40(4,5)47)24-27-42(38,7)35(45)30-44(32,43)9/h31-36,38,45,47H,10-30H2,1-9H3
InChIKey WWMFNEDCFMWTHA-UHFFFAOYSA-N
Literature Reference Author T.J.SCHMIDT,J.VONRAISON,G.WILLUHN
Literature Reference Citation PLANTA.MED.,70,967(2004)
Literature Reference DOI 10.1055/s-2004-832624
Molecular Weight 671.101 g/mol
Solvent CDCl3
Source File Reference UWMZ48515