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CALLILONGISIN_B
SpectraBase Compound ID CKkuvEJyPc1
InChI InChI=1S/C20H30O3/c1-13(2)16-7-6-15-12-19(22,14(3)4)10-11-20(15)18(16,5)9-8-17(21)23-20/h12,14,16,22H,1,6-11H2,2-5H3/t16-,18-,19-,20+/m0/s1
InChIKey ZCZSUKMDYVTMIA-FRYIKTPZSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DoPXm9yTaqX
Name CALLILONGISIN_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-13(2)16-7-6-15-12-19(22,14(3)4)10-11-20(15)18(16,5)9-8-17(21)23-20/h12,14,16,22H,1,6-11H2,2-5H3/t16-,18-,19-,20+/m0/s1
InChIKey ZCZSUKMDYVTMIA-FRYIKTPZSA-N
Literature Reference Author Y.W.LIU,Y.B.CHENG,C.C.LIAW,C.H.CHEN,J.H.GUH,T.L.HWANG,J.S.TS AI,W.B.WANG,Y.C.SHEN
Literature Reference Citation J.NAT.PROD.,75,689(2012)
Literature Reference DOI 10.1021/np200932k
Molecular Weight 318.456 g/mol
Sample ID 40292
Solvent CDCl3