For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-BETA,(23S)-DIHYDROXY-ERGOSTA-5,7-DIEN-22-ONE
SpectraBase Compound ID 8a5tBInDxOI
InChI InChI=1S/C28H44O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h7-8,16-18,20,22-25,29-30H,9-15H2,1-6H3/t17-,18+,20+,22-,23+,24+,25+,27+,28-/m1/s1
InChIKey NITBBNYQKGEBBL-AUWZZCDMSA-N
Mol Weight 428.7 g/mol
Molecular Formula C28H44O3
Exact Mass 428.329045 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9LXE70q7PIg
Name 3-BETA,(23S)-DIHYDROXY-ERGOSTA-5,7-DIEN-22-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O3
InChI InChI=1S/C28H44O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h7-8,16-18,20,22-25,29-30H,9-15H2,1-6H3/t17-,18+,20+,22-,23+,24+,25+,27+,28-/m1/s1
InChIKey NITBBNYQKGEBBL-AUWZZCDMSA-N
Literature Reference Author R.C.TUCKEY,M.N.NGUYEN,J.CHEN,A.T.SLOMINSKI,D.M.BALDISSERI,E. W.TIEU,J.K.ZJAWIONY,
Literature Reference Citation DRUG.MET.DISP.,40,436(2012)
Literature Reference DOI 10.1124/dmd.111.042515
Molecular Weight 428.656 g/mol
Source File Reference UWLU75274