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5-ALPHA,8-ALPHA-EPIDIOXY-CHOLEST-6,22-DIEN-3-BETE-OL
SpectraBase Compound ID EPQfWvuF7JK
InChI InChI=1S/C27H42O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25)15-16-27(22,23)30-29-26/h6,8,15-16,18-23,28H,7,9-14,17H2,1-5H3/b8-6+/t19-,20+,21-,22-,23-,24-,25-,26-,27+/m1/s1
InChIKey WISOACODKWCRQK-XRLZFMEMSA-N
Mol Weight 414.6 g/mol
Molecular Formula C27H42O3
Exact Mass 414.313395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Jsx0c72mLR
Name 5-ALPHA,8-ALPHA-EPIDIOXY-CHOLEST-6,22-DIEN-3-BETE-OL
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O3
InChI InChI=1S/C27H42O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25)15-16-27(22,23)30-29-26/h6,8,15-16,18-23,28H,7,9-14,17H2,1-5H3/b8-6+/t19-,20+,21-,22-,23-,24-,25-,26-,27+/m1/s1
InChIKey WISOACODKWCRQK-XRLZFMEMSA-N
Literature Reference Author X.ZHOU,X.LIN,X.GUO,B.YANG,X.W.YANG,Y.LIU
Literature Reference Citation REC.NAT.PROD.,7,119(2013)
Molecular Weight 414.629 g/mol
Solvent CDCl3
Source File Reference UWLU80845