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

*Links on SpectraBase are not permalinks.
TOPSENTISTEROL_C4;(24-R,25-R,27-R)-26,27-CYCLO-24,27-DIMETHYLCHOLEST-7-ENE-3-BETA,5-ALPHA,6-BETA-TRIOL
SpectraBase Compound ID IOLiiXo1IPn
InChI InChI=1S/C29H48O3/c1-17(21-14-19(21)3)6-7-18(2)23-8-9-24-22-15-26(31)29(32)16-20(30)10-13-28(29,5)25(22)11-12-27(23,24)4/h15,17-21,23-26,30-32H,6-14,16H2,1-5H3/t17-,18-,19+,20+,21-,23-,24+,25+,26-,27-,28-,29+/m1/s1
InChIKey XBQGUBDBOJFWAO-ALDRTUNSSA-N
Mol Weight 444.7 g/mol
Molecular Formula C29H48O3
Exact Mass 444.360345 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 8CghEoeEBDh
Name TOPSENTISTEROL_C4;(24-R,25-R,27-R)-26,27-CYCLO-24,27-DIMETHYLCHOLEST-7-ENE-3-BETA,5-ALPHA,6-BETA-TRIOL
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H48O3
InChI InChI=1S/C29H48O3/c1-17(21-14-19(21)3)6-7-18(2)23-8-9-24-22-15-26(31)29(32)16-20(30)10-13-28(29,5)25(22)11-12-27(23,24)4/h15,17-21,23-26,30-32H,6-14,16H2,1-5H3/t17-,18-,19+,20+,21-,23-,24+,25+,26-,27-,28-,29+/m1/s1
InChIKey XBQGUBDBOJFWAO-ALDRTUNSSA-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 444.698 g/mol
Solvent CD3OD
Source File Reference UWMZ17637