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TOPSENTISTEROL_E1;1-(10->6)-ABEO-(22-E)-24-ZETA-METHYLCHOLESTA-5,7,9,22-TETRAENE-3-ALPHA,11-ALPHA-DIOL
SpectraBase Compound ID GEjn5oBi7L0
InChI InChI=1S/C28H42O2/c1-16(2)17(3)7-8-18(4)24-11-12-25-23-13-20-9-10-21(29)14-22(20)19(5)27(23)26(30)15-28(24,25)6/h7-8,13,16-18,21,24-26,29-30H,9-12,14-15H2,1-6H3/b8-7+/t17?,18-,21-,24-,25+,26-,28-/m1/s1
InChIKey PWOLTSTXQZMPQX-XFKBMAJBSA-N
Mol Weight 410.6 g/mol
Molecular Formula C28H42O2
Exact Mass 410.318481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H989MA11GBY
Name TOPSENTISTEROL_E1;1-(10->6)-ABEO-(22-E)-24-ZETA-METHYLCHOLESTA-5,7,9,22-TETRAENE-3-ALPHA,11-ALPHA-DIOL
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O2
InChI InChI=1S/C28H42O2/c1-16(2)17(3)7-8-18(4)24-11-12-25-23-13-20-9-10-21(29)14-22(20)19(5)27(23)26(30)15-28(24,25)6/h7-8,13,16-18,21,24-26,29-30H,9-12,14-15H2,1-6H3/b8-7+/t17?,18-,21-,24-,25+,26-,28-/m1/s1
InChIKey PWOLTSTXQZMPQX-XFKBMAJBSA-N
Literature Reference Author X.LUO,F.LI,P.B.SHINDE,J.HONG,C.O.LEE,K.S.IM,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,69,1760(2006)
Literature Reference DOI 10.1021/np0604026
Molecular Weight 410.640 g/mol
Solvent CD3OD
Source File Reference UWMZ17638