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15,16-EPOXY-18A-HOMO-18-TOSYL-1(10),13(16),14-ENT-HALIMATRIEN-12S,18-DIOL
SpectraBase Compound ID 3ERINMhJZEM
InChI InChI=1S/C28H38O5S/c1-20-7-10-23(11-8-20)34(30,31)33-17-15-27(3)14-5-6-25-24(27)12-9-21(2)28(25,4)18-26(29)22-13-16-32-19-22/h6-8,10-11,13,16,19,21,24,26,29H,5,9,12,14-15,17-18H2,1-4H3/t21-,24+,26+,27-,28+/m1/s1
InChIKey LPTBKLVVYJDYQI-JUCQVTBNSA-N
Mol Weight 486.7 g/mol
Molecular Formula C28H38O5S
Exact Mass 486.243995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BldpeiFizS1
Name 15,16-EPOXY-18A-HOMO-18-TOSYL-1(10),13(16),14-ENT-HALIMATRIEN-12S,18-DIOL
Compound Number 46
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38O5S
InChI InChI=1S/C28H38O5S/c1-20-7-10-23(11-8-20)34(30,31)33-17-15-27(3)14-5-6-25-24(27)12-9-21(2)28(25,4)18-26(29)22-13-16-32-19-22/h6-8,10-11,13,16,19,21,24,26,29H,5,9,12,14-15,17-18H2,1-4H3/t21-,24+,26+,27-,28+/m1/s1
InChIKey LPTBKLVVYJDYQI-JUCQVTBNSA-N
Literature Reference Author I.S.MARCOS,A.B.PEDRERO,M.J.SEXMERO,D.DIEZ,P.BASABE,N.GARCIA, R.F.MORO,H.B.BROUGHT
Literature Reference Citation J.ORG.CHEM.,68,7496(2003)
Literature Reference DOI 10.1021/jo034663l
Molecular Weight 486.667 g/mol
Solvent CDCl3
Source File Reference UWSI22454