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3-BETA,28-DIACETOXY-(20R)-LUPAN-29-AL
SpectraBase Compound ID yJSE7zyWTw
InChI InChI=1S/C34H54O5/c1-21(19-35)24-11-16-34(20-38-22(2)36)18-17-32(7)25(29(24)34)9-10-27-31(6)14-13-28(39-23(3)37)30(4,5)26(31)12-15-33(27,32)8/h19,21,24-29H,9-18,20H2,1-8H3/t21-,24-,25+,26-,27+,28-,29+,31-,32+,33+,34+/m0/s1
InChIKey LNRJCBGQWNGAJY-KFKPXHRESA-N
Mol Weight 542.8 g/mol
Molecular Formula C34H54O5
Exact Mass 542.397125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kd1R61Lbtj2
Name 3-BETA,28-DIACETOXY-(20R)-LUPAN-29-AL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54O5
InChI InChI=1S/C34H54O5/c1-21(19-35)24-11-16-34(20-38-22(2)36)18-17-32(7)25(29(24)34)9-10-27-31(6)14-13-28(39-23(3)37)30(4,5)26(31)12-15-33(27,32)8/h19,21,24-29H,9-18,20H2,1-8H3/t21-,24-,25+,26-,27+,28-,29+,31-,32+,33+,34+/m0/s1
InChIKey LNRJCBGQWNGAJY-KFKPXHRESA-N
Literature Reference Author I.OKAMOTO,T.TAKEYA,Y.KAGAWA,E.KOTANI
Literature Reference Citation CHEM.PHARM.BULL.,48,120(2000)
Literature Reference DOI 10.1248/cpb.48.120
Molecular Weight 542.800 g/mol
Solvent CDCl3
Source File Reference UWLU4848