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THORECTIDAEOLIDE_A

View entire compound with spectra: 1 NMR

THORECTIDAEOLIDE_A
SpectraBase Compound ID 1fXxuaSwF5a
InChI InChI=1S/C25H36O4/c1-17(9-12-21-19(3)11-14-23(27)25(21,4)5)7-6-8-18(2)10-13-22(26)20-15-24(28)29-16-20/h7,10,15,22,26H,6,8-9,11-14,16H2,1-5H3/b17-7+,18-10+/t22-/m1/s1
InChIKey AWUVHJURSARGNS-XNSVFUCTSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8yBGBR6WDpm
Name THORECTIDAEOLIDE_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-17(9-12-21-19(3)11-14-23(27)25(21,4)5)7-6-8-18(2)10-13-22(26)20-15-24(28)29-16-20/h7,10,15,22,26H,6,8-9,11-14,16H2,1-5H3/b17-7+,18-10+/t22-/m1/s1
InChIKey AWUVHJURSARGNS-XNSVFUCTSA-N
Literature Reference Author J.LI,L.DU,M.KELLY,Y.D.ZHOU,D.G.NAGLE
Literature Reference Citation J.NAT.PROD.,76,1492(2013)
Literature Reference DOI 10.1021/np400350k
Molecular Weight 400.558 g/mol
Solvent CDCl3
Source File Reference UWMZ43065