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ENT-3-BETA,18-DIACETOXY-19-TRACHYLOBANOIC_ACID
SpectraBase Compound ID EzdGbVxlZNq
InChI InChI=1S/C24H34O6/c1-13(25)29-12-24(20(27)28)17-5-8-23-10-16-15(22(16,4)11-23)9-18(23)21(17,3)7-6-19(24)30-14(2)26/h15-19H,5-12H2,1-4H3,(H,27,28)/t15-,16-,17+,18+,19-,21-,22+,23+,24+/m1/s1
InChIKey LHKQQWKOWNPPSN-KUYGQCCZSA-N
Mol Weight 418.5 g/mol
Molecular Formula C24H34O6
Exact Mass 418.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fn5HjtDfQz
Name ENT-3-BETA,18-DIACETOXY-19-TRACHYLOBANOIC_ACID
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H34O6
InChI InChI=1S/C24H34O6/c1-13(25)29-12-24(20(27)28)17-5-8-23-10-16-15(22(16,4)11-23)9-18(23)21(17,3)7-6-19(24)30-14(2)26/h15-19H,5-12H2,1-4H3,(H,27,28)/t15-,16-,17+,18+,19-,21-,22+,23+,24+/m1/s1
InChIKey LHKQQWKOWNPPSN-KUYGQCCZSA-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 418.530 g/mol
Sample ID 35294
Solvent CDCl3