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NEMORALISIN_B
SpectraBase Compound ID 9SxHe8nW5Og
InChI InChI=1S/C20H28O5/c1-12-8-15(24-19(23)9-12)10-14(3)16(21)7-6-13(2)17-11-18(22)20(4,5)25-17/h9-11,13,15-16,21H,6-8H2,1-5H3/b14-10+/t13-,15-,16+/m1/s1
InChIKey MVGBWGQAUHVNGU-PAAVRJFSSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 66dusRWZ1F4
Name NEMORALISIN_B
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-12-8-15(24-19(23)9-12)10-14(3)16(21)7-6-13(2)17-11-18(22)20(4,5)25-17/h9-11,13,15-16,21H,6-8H2,1-5H3/b14-10+/t13-,15-,16+/m1/s1
InChIKey MVGBWGQAUHVNGU-PAAVRJFSSA-N
Literature Reference Author Y.ZHANG,J.S.WANG,D.D.WEI,Y.C.GU,X.B.WANG,L.Y.KONG
Literature Reference Citation J.NAT.PROD.,76,1191(2013)
Literature Reference DOI 10.1021/np400126q
Molecular Weight 348.439 g/mol
Sample ID 42690
Solvent CDCl3