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

*Links on SpectraBase are not permalinks.
(3-BETA,22E)-STIGMASTA-5,22-DIEN-3-YL-4-(2-AMINOETHYLAMINO)-4-OXO-BUTANOATE
SpectraBase Compound ID LayNifoDEoT
InChI InChI=1S/C35H58N2O3/c1-7-25(23(2)3)9-8-24(4)29-12-13-30-28-11-10-26-22-27(40-33(39)15-14-32(38)37-21-20-36)16-18-34(26,5)31(28)17-19-35(29,30)6/h8-10,23-25,27-31H,7,11-22,36H2,1-6H3,(H,37,38)/b9-8+/t24-,25-,27+,28+,29-,30+,31+,34+,35-/m1/s1
InChIKey GQMGEHKGCGTKBV-GFWAPOSYSA-N
Mol Weight 554.9 g/mol
Molecular Formula C35H58N2O3
Exact Mass 554.444744 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 HZJypEOe2Mq
Name (3-BETA,22E)-STIGMASTA-5,22-DIEN-3-YL-4-(2-AMINOETHYLAMINO)-4-OXO-BUTANOATE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H58N2O3
InChI InChI=1S/C35H58N2O3/c1-7-25(23(2)3)9-8-24(4)29-12-13-30-28-11-10-26-22-27(40-33(39)15-14-32(38)37-21-20-36)16-18-34(26,5)31(28)17-19-35(29,30)6/h8-10,23-25,27-31H,7,11-22,36H2,1-6H3,(H,37,38)/b9-8+/t24-,25-,27+,28+,29-,30+,31+,34+,35-/m1/s1
InChIKey GQMGEHKGCGTKBV-GFWAPOSYSA-N
Literature Reference Author N.VIDA,H.SVOBODOVA,L.RAROVA,P.DRASAR,D.SAMAN,J.CVACKA,Z.WIMM ER
Literature Reference Citation STEROIDS,77,1212(2012)
Literature Reference DOI 10.1016/j.steroids.2012.07.009
Molecular Weight 554.857 g/mol
Sample ID 70723
Solvent CD3OD