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SENECIOVALTRATE
SpectraBase Compound ID DMGb8jfJrG4
InChI InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1
InChIKey ZHFDCOHUCIESBS-KVJIRVJXSA-N
Mol Weight 420.46 g/mol
Molecular Formula C22H28O8
Exact Mass 420.178418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Y5cJoYIC9J
Name SENECIOVALTRATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O8
InChI InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1
InChIKey ZHFDCOHUCIESBS-KVJIRVJXSA-N
Literature Reference Author Y.M.XU,S.P.MCLAUGHLIN,A.A.L.GUNATILAKA
Literature Reference Citation J.NAT.PROD.,70,2045(2007)
Literature Reference DOI 10.1021/np0704553
Molecular Weight 420.460 g/mol
Sample ID 31286
Solvent CDCl3