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15-EPI-CYLLENIN_A

View entire compound with spectra: 1 NMR

15-EPI-CYLLENIN_A
SpectraBase Compound ID IC9Df8PSUBQ
InChI InChI=1S/C20H30O5/c1-12-9-13-15-17(2,16(22)24-13)5-4-6-18(15,3)20(12)8-7-19(25-20)10-14(21)23-11-19/h12-15,21H,4-11H2,1-3H3/t12-,13-,14-,15+,17+,18+,19+,20-/m1/s1
InChIKey IACFKHAQKGTVTR-VUKVDKESSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPDbJD1YPdy
Name 15-EPI-CYLLENIN_A
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-12-9-13-15-17(2,16(22)24-13)5-4-6-18(15,3)20(12)8-7-19(25-20)10-14(21)23-11-19/h12-15,21H,4-11H2,1-3H3/t12-,13-,14-,15+,17+,18+,19+,20-/m1/s1
InChIKey IACFKHAQKGTVTR-VUKVDKESSA-N
Literature Reference Author D.RIGANO,A.GRASSIA,M.BRUNO,S.ROSSELLI,F.PIOZZI,C.FORMISANO,N .A.ARNOLD,F.SENATORE
Literature Reference Citation J.NAT.PROD.,69,836(2006)
Literature Reference DOI 10.1021/np0505420
Molecular Weight 350.455 g/mol
Solvent CDCl3
Source File Reference UWMZ18445