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HETERANTHIN;METHYL_3-OXO-12'-APO-EPSILON-CAROTEN-12'-OATE
SpectraBase Compound ID F5PJMvDxQ0v
InChI InChI=1S/C26H34O3/c1-19(11-8-9-14-21(3)25(28)29-7)12-10-13-20(2)15-16-24-22(4)17-23(27)18-26(24,5)6/h8-17,24H,18H2,1-7H3/b9-8+,12-10+,16-15+,19-11+,20-13+,21-14+/t24-/m1/s1
InChIKey NRLVZXUWVPUCFW-WFCITUQGSA-N
Mol Weight 394.6 g/mol
Molecular Formula C26H34O3
Exact Mass 394.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3K1Wv4yFSZv
Name HETERANTHIN;METHYL_3-OXO-12'-APO-EPSILON-CAROTEN-12'-OATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O3
InChI InChI=1S/C26H34O3/c1-19(11-8-9-14-21(3)25(28)29-7)12-10-13-20(2)15-16-24-22(4)17-23(27)18-26(24,5)6/h8-17,24H,18H2,1-7H3/b9-8+,12-10+,16-15+,19-11+,20-13+,21-14+/t24-/m1/s1
InChIKey NRLVZXUWVPUCFW-WFCITUQGSA-N
Literature Reference Author M.D.MENDEZ-ROBLES,H.H.PERMADY,M.E.JARAMILLO-FLORES,E.C.LUGO- CERVANTES,A.CARDADOR
Literature Reference Citation J.NAT.PROD.,69,1140(2006)
Literature Reference DOI 10.1021/np050489f
Molecular Weight 394.554 g/mol
Solvent CDCl3
Source File Reference UWMZ15689