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ERGOSTA-4,6,8,22-TETRAEN-3-ONE

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ERGOSTA-4,6,8,22-TETRAEN-3-ONE
SpectraBase Compound ID 7mjCPSzEXqe
InChI InChI=1S/C28H40O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,17-20,24-25H,11-16H2,1-6H3/b8-7+/t19?,20?,24-,25?,27+,28-/m1/s1
InChIKey PVOXMLZUXQNIHC-OUUFYQQSSA-N
Mol Weight 392.6 g/mol
Molecular Formula C28H40O
Exact Mass 392.307916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9X59AF2VDJ2
Name ERGOSTA-4,6,8,22-TETRAEN-3-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40O
InChI InChI=1S/C28H40O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,17-20,24-25H,11-16H2,1-6H3/b8-7+/t19?,20?,24-,25?,27+,28-/m1/s1
InChIKey PVOXMLZUXQNIHC-OUUFYQQSSA-N
Literature Reference Author V.CHOBOT,L.OPLETAL,L.JAHODAR,A.V.PATEL,C.G.DACKE,G.BLUNDEN
Literature Reference Citation PHYTOCHEM.,45,1669(1997)
Literature Reference DOI 10.1016/S0031-9422(97)00249-5
Molecular Weight 392.625 g/mol
Solvent CDCl3
Source File Reference UWSP393