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(22R,23E)-22-PHENYL-25-[(METHOXYMETHYL)-OXY]-DES-A,B-CHOLEST-23-EN-8-ONE
SpectraBase Compound ID GQk9tdoqnUB
InChI InChI=1S/C26H38O3/c1-19(22-13-14-23-24(27)12-9-16-26(22,23)4)21(20-10-7-6-8-11-20)15-17-25(2,3)29-18-28-5/h6-8,10-11,15,17,19,21-23H,9,12-14,16,18H2,1-5H3/b17-15+/t19-,21-,22-,23+,26-/m1/s1
InChIKey FSOALKGJJYQUOO-MMZDBHPVSA-N
Mol Weight 398.6 g/mol
Molecular Formula C26H38O3
Exact Mass 398.282095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AdkcOp6BubT
Name (22R,23E)-22-PHENYL-25-[(METHOXYMETHYL)-OXY]-DES-A,B-CHOLEST-23-EN-8-ONE
Compound Number 16F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38O3
InChI InChI=1S/C26H38O3/c1-19(22-13-14-23-24(27)12-9-16-26(22,23)4)21(20-10-7-6-8-11-20)15-17-25(2,3)29-18-28-5/h6-8,10-11,15,17,19,21-23H,9,12-14,16,18H2,1-5H3/b17-15+/t19-,21-,22-,23+,26-/m1/s1
InChIKey FSOALKGJJYQUOO-MMZDBHPVSA-N
Literature Reference Author M.TORNEIRO,Y.FALL,L.CASTEDO,A.MOURINO
Literature Reference Citation J.ORG.CHEM.,62,6344(1997)
Literature Reference DOI 10.1021/jo970604u
Molecular Weight 398.586 g/mol
Solvent CDCl3
Source File Reference UWMZ4431