John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IIE1DBLBRqA SpectraBase Spectrum ID=105znlephFL

(accessed ).
STEMOKERRINE
SpectraBase Compound ID IIE1DBLBRqA
InChI InChI=1S/C22H31NO5/c1-5-16(24)14-8-6-9-15-18-12(2)20(27-17(18)10-7-11-23(14)15)21-19(26-4)13(3)22(25)28-21/h10,12,14-16,18,24H,5-9,11H2,1-4H3/b21-20-/t12-,14+,15-,16+,18+/m0/s1
InChIKey KLADGQYNEYECIT-LFVNKPDISA-N
Mol Weight 389.49 g/mol
Molecular Formula C22H31NO5
Exact Mass 389.220223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 105znlephFL
Name STEMOKERRINE
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO5
InChI InChI=1S/C22H31NO5/c1-5-16(24)14-8-6-9-15-18-12(2)20(27-17(18)10-7-11-23(14)15)21-19(26-4)13(3)22(25)28-21/h10,12,14-16,18,24H,5-9,11H2,1-4H3/b21-20-/t12-,14+,15-,16+,18+/m0/s1
InChIKey KLADGQYNEYECIT-LFVNKPDISA-N
Literature Reference Author L.LIN,H.BAO,A.WANG,C.TANG,P.H.DIEN,Y.YE
Literature Reference Citation MOLECULES,19,20257(2014)
Literature Reference DOI 10.3390/molecules191220257
Molecular Weight 389.492 g/mol
Solvent CDCl3
Source File Reference UWLU81631
SpectraBase Batch ID jxPwEe8G3G