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ent-18-.alpha.-Acetoxy-3.beta.-hydroxytrachylobane
SpectraBase Compound ID CdmojrLkTUF
InChI InChI=1S/C22H34O3/c1-13(23)25-12-21(4)16-5-8-22-10-15-14(20(15,3)11-22)9-17(22)19(16,2)7-6-18(21)24/h14-18,24H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22+/m1/s1
InChIKey ZPBBRJYUYLDTJN-QZRXDCOGSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 37yY6dPFTsA
Name ENT-18-ALPHA-ACETOXY-3-BETA-HYDROXY-TRACHYLOBANE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-13(23)25-12-21(4)16-5-8-22-10-15-14(20(15,3)11-22)9-17(22)19(16,2)7-6-18(21)24/h14-18,24H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22+/m1/s1
InChIKey ZPBBRJYUYLDTJN-QZRXDCOGSA-N
Literature Reference Author J.M.SCHER,A.SCHINKOVITZ,J.ZAPP,Y.WANG,S.G.FRANZBLAU,H.BECKER ,D.C.LANKIN,G.F.PAUL
Literature Reference Citation J.NAT.PROD.,73,656(2010)
Literature Reference DOI 10.1021/np900806j
Molecular Weight 346.510 g/mol
Sample ID 35287
Solvent CDCl3