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

*Links on SpectraBase are not permalinks.

(4A-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXO-1-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE

Compound with spectra: 1 NMR

(4A-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXO-1-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
SpectraBase Compound ID HqcKuFIFfi3
InChI InChI=1S/C31H37N5O4S/c1-31(2,3)40-29(39)34-25(16-21-18-32-23-13-8-7-12-22(21)23)28(38)33-24-14-9-15-35-26(24)17-27(37)36(30(35)41)19-20-10-5-4-6-11-20/h4-8,10-13,18,24-26,32H,9,14-17,19H2,1-3H3,(H,33,38)(H,34,39)/t24-,25-,26+/m0/s1
InChIKey XCJKSJQOSBEHKV-KKUQBAQOSA-N
Mol Weight 575.7 g/mol
Molecular Formula C31H37N5O4S
Exact Mass 575.256626 g/mol
Enantiomer InChIKey XCJKSJQOSBEHKV-CYXNTTPDSA-N

View Spectrum of (4A-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXO-1-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
(4A-S*,5-R*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXO-1-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
(4A-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-1,3-DITHIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
(4A-S*,5-R*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-1,3-DITHIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
(4A-S*,5-R*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-1-OXO-3-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
(4A-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-1-OXO-3-THIOXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
SUNGSANPIN
CHRYSAIBOL
LOLOATIN-D;CYClIC-(L-ASPARAGINYL-L-ASPARTYL-L-TRYPTOPHANE-L-VALYL-L-ORNITHINYL-L-LEUCYL-D-TYROSYL-L-TRANS-4-HYDROXYPROLYL-L-PHENYLALANYL-D-PHENYLALANYL);COMPOU
MICROSCLERODERMIN-J
4-Methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3-carboxylic acid tert-butyl ester
Title Journal or Book Year
5-(Tryptophyl)amino-1,3-dioxoperhydropyrido[1,2-c]pyrimidine-Based Potent and Selective CCK1 Receptor Antagonists:  Structure−Activity Relationship Studies on the Central 1,3-Dioxoperhydropyrido[1,2-c]pyrimidine Scaffold Journal of Medicinal Chemistry 2001
Other Resources
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.