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

*Links on SpectraBase are not permalinks.
HELIGENIN-A;(2R,3R,20R)-2,20-DIHYDROXY-3,21-DIMETHOXY-PREGN-5-EN-7-ONE
SpectraBase Compound ID AxXUZVqsoCb
InChI InChI=1S/C23H36O5/c1-22-8-7-16-21(15(22)6-5-14(22)19(26)12-27-3)17(24)9-13-10-20(28-4)18(25)11-23(13,16)2/h9,14-16,18-21,25-26H,5-8,10-12H2,1-4H3/t14-,15+,16+,18-,19+,20-,21+,22-,23+/m1/s1
InChIKey NFALXEQTFWVCDH-FRQKSQBMSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 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 GJxdEjVJL8S
Name HELIGENIN-A;(2R,3R,20R)-2,20-DIHYDROXY-3,21-DIMETHOXY-PREGN-5-EN-7-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-22-8-7-16-21(15(22)6-5-14(22)19(26)12-27-3)17(24)9-13-10-20(28-4)18(25)11-23(13,16)2/h9,14-16,18-21,25-26H,5-8,10-12H2,1-4H3/t14-,15+,16+,18-,19+,20-,21+,22-,23+/m1/s1
InChIKey NFALXEQTFWVCDH-FRQKSQBMSA-N
Literature Reference Author G.C.WANG,T.LI,Y.R.WEI,Y.B.ZHANG,Y.L.LI,S.C.W.SZE,W.C.YE
Literature Reference Citation FITOTERAPIA,83,1643(2012)
Literature Reference DOI 10.1016/j.fitote.2012.09.016
Molecular Weight 392.536 g/mol
Sample ID 72124
Solvent CD3OD