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

*Links on SpectraBase are not permalinks.
5-BETA-ANDROSTANE-3-ALPHA,17-BETA-DIYL-17-(PENTAFLUOROBENZOATE)-3-(L-GLUTAMATE)
SpectraBase Compound ID BjrS3kZZEvR
InChI InChI=1S/C31H38F5NO6/c1-30-11-9-15(42-28(40)19(37)6-8-21(38)39)13-14(30)3-4-16-17-5-7-20(31(17,2)12-10-18(16)30)43-29(41)22-23(32)25(34)27(36)26(35)24(22)33/h14-20H,3-13,37H2,1-2H3,(H,38,39)/t14-,15-,16+,17+,18+,19+,20+,30+,31+/m1/s1
InChIKey LNBZDWYMMKQMGU-LAWYNKPISA-N
Mol Weight 615.6 g/mol
Molecular Formula C31H38F5NO6
Exact Mass 615.261929 g/mol
Enantiomer InChIKey LNBZDWYMMKQMGU-CHMXODJQSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OD=10:1
Title Journal or Book Year
Neuroactive steroids with perfluorobenzoyl group Steroids 2012

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.