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XLIFCYLFFHWALC-DXMJCNQSSA-N

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XLIFCYLFFHWALC-DXMJCNQSSA-N
SpectraBase Compound ID JJYtB2dEAma
InChI InChI=1S/C21H32O7/c1-11(10-27-20-19(26)18(25)17(24)16(9-22)28-20)14-8-21(3)12(2)5-4-6-13(21)7-15(14)23/h7,10,12,14,16-20,22,24-26H,4-6,8-9H2,1-3H3/b11-10+/t12-,14-,16+,17+,18+,19+,20+,21+/m0/s1
InChIKey XLIFCYLFFHWALC-DXMJCNQSSA-N
Mol Weight 396.5 g/mol
Molecular Formula C21H32O7
Exact Mass 396.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dy0K6xevdrt
Name XLIFCYLFFHWALC-DXMJCNQSSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O7
InChI InChI=1S/C21H32O7/c1-11(10-27-20-19(26)18(25)17(24)16(9-22)28-20)14-8-21(3)12(2)5-4-6-13(21)7-15(14)23/h7,10,12,14,16-20,22,24-26H,4-6,8-9H2,1-3H3/b11-10+/t12-,14-,16+,17+,18+,19+,20+,21+/m0/s1
InChIKey XLIFCYLFFHWALC-DXMJCNQSSA-N
Literature Reference Author A.ARCINIEGAS,K.GONZALEZ,A.L.PEREZ-CASTORENA,J.MALDONADO,J.L. VILLASENOR,A.R.DEVIV
Literature Reference Citation J.NAT.PROD.,74,1584(2011)
Literature Reference DOI 10.1021/np200188w
Molecular Weight 396.481 g/mol
Sample ID 39026
Solvent CD3OD