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3-BETA-HYDROXY-8-ALPHA,9-ALPHA-SECOERGOSTA-7,9(11),22-TRIENE;TYLOPIOL-A
SpectraBase Compound ID 7NkpjWOhaYI
InChI InChI=1S/C28H44O2/c1-18(2)19(3)7-8-20(4)23-10-11-24-25-12-9-21-17-22(29)13-15-27(21,5)26(30-25)14-16-28(23,24)6/h7-8,12,14,18-24,29H,9-11,13,15-17H2,1-6H3/b8-7+/t19-,20-,21?,22+,23-,24?,27+,28-/m1/s1
InChIKey CINZVIXZRUAXFE-RMTFJZSJSA-N
Mol Weight 412.7 g/mol
Molecular Formula C28H44O2
Exact Mass 412.334131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYwPjYgoHFB
Name 3-BETA-HYDROXY-8-ALPHA,9-ALPHA-SECOERGOSTA-7,9(11),22-TRIENE;TYLOPIOL-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O2
InChI InChI=1S/C28H44O2/c1-18(2)19(3)7-8-20(4)23-10-11-24-25-12-9-21-17-22(29)13-15-27(21,5)26(30-25)14-16-28(23,24)6/h7-8,12,14,18-24,29H,9-11,13,15-17H2,1-6H3/b8-7+/t19-,20-,21?,22+,23-,24?,27+,28-/m1/s1
InChIKey CINZVIXZRUAXFE-RMTFJZSJSA-N
Literature Reference Author S.H.WU,X.D.LUO,Y.B.MA,J.K.LIU,D.G.WU,B.ZHAO,Y.LU,Q.T.ZHENG
Literature Reference Citation J.NAT.PROD.,63,534(2000)
Literature Reference DOI 10.1021/np990494h
Molecular Weight 412.656 g/mol
Solvent PYRIDINE-D5
Source File Reference UWRU5752