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ERGOSTA-4,6,8(14),22-TETRAEN-3-ONE

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ERGOSTA-4,6,8(14),22-TETRAEN-3-ONE
SpectraBase Compound ID 60bTDR7CQRH
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/h7-10,17-20,24,26H,11-16H2,1-6H3/b8-7+/t19?,20-,24-,26+,27+,28-/m1/s1
InChIKey OIMXTYUHMBQQJM-TWUMTVRRSA-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 D9PDFMmZwkD
Name ERGOSTA-4,6,8(14),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/h7-10,17-20,24,26H,11-16H2,1-6H3/b8-7+/t19?,20-,24-,26+,27+,28-/m1/s1
InChIKey OIMXTYUHMBQQJM-TWUMTVRRSA-N
Literature Reference Author K.H.GAN,S.H.KUO,C.N.LIN
Literature Reference Citation J.NAT.PROD.,61,1421(1998)
Literature Reference DOI 10.1021/np980184j
Molecular Weight 392.625 g/mol
Solvent CDCl3
Source File Reference UWCS19565