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LUPEOL-BETA-PHENYLPROPIONATE

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LUPEOL-BETA-PHENYLPROPIONATE
SpectraBase Compound ID Isj8B4YmATb
InChI InChI=1S/C39H58O2/c1-26(2)28-18-21-36(5)24-25-38(7)29(34(28)36)15-16-31-37(6)22-20-32(35(3,4)30(37)19-23-39(31,38)8)41-33(40)17-14-27-12-10-9-11-13-27/h9-13,28-32,34H,1,14-25H2,2-8H3/t28-,29+,30-,31+,32-,34+,36+,37-,38+,39+/m0/s1
InChIKey BXSJJYBMAUOEPV-HBHILWERSA-N
Mol Weight 558.9 g/mol
Molecular Formula C39H58O2
Exact Mass 558.443681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C15MM9RIRgJ
Name LUPEOL-BETA-PHENYLPROPIONATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H58O2
InChI InChI=1S/C39H58O2/c1-26(2)28-18-21-36(5)24-25-38(7)29(34(28)36)15-16-31-37(6)22-20-32(35(3,4)30(37)19-23-39(31,38)8)41-33(40)17-14-27-12-10-9-11-13-27/h9-13,28-32,34H,1,14-25H2,2-8H3/t28-,29+,30-,31+,32-,34+,36+,37-,38+,39+/m0/s1
InChIKey BXSJJYBMAUOEPV-HBHILWERSA-N
Literature Reference Author C.A.WOOD,K.LEE,A.J.VAISBERG,D.G.I.KINGSTON,C.C.NETO,G.B.HAMM OND
Literature Reference Citation CHEM.PHARM.BULL.,49,1477(2001)
Literature Reference DOI 10.1248/cpb.49.1477
Molecular Weight 558.888 g/mol
Solvent CDCl3
Source File Reference UWVN29086