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

*Links on SpectraBase are not permalinks.

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

Compound with spectra: 1 NMR

(4A-S*,5-R*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
SpectraBase Compound ID INbOC2XUj9H
InChI InChI=1S/C31H39N5O4/c1-31(2,3)40-30(39)34-26(16-22-18-32-24-13-8-7-12-23(22)24)29(38)33-25-14-9-15-35-20-36(28(37)17-27(25)35)19-21-10-5-4-6-11-21/h4-8,10-13,18,25-27,32H,9,14-17,19-20H2,1-3H3,(H,33,38)(H,34,39)/t25-,26+,27+/m1/s1
InChIKey HZERTLNBHOHXEE-PVHODMMVSA-N
Mol Weight 545.7 g/mol
Molecular Formula C31H39N5O4
Exact Mass 545.300205 g/mol
Enantiomer InChIKey HZERTLNBHOHXEE-OYUWMTPXSA-N

View Spectrum of (4A-S*,5-R*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXOPERHYDROPYRIDO-[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-R*,5-S*)-2-BENZYL-5-[N-(TERT.-BUTOXYCARBONYL)-L-TRYPTOPHYL]-AMINO-3-OXOPERHYDROPYRIDO-[1,2-C]-PYRIMIDINE
CBZ-N-L-TRP-L-(4-O-ME)-TRP-GLY-O-ME
INTEGERRIMIDE_B;TRANS-CONFORMER;CYCLO-(-TRP-(1)-ALA-(2)-LEU-(3)-LEU-(4)-VAL-(5)-SER-(6)-PRO-(7)-)
Cyclo(phenylalanyl-D-tryptophyl-[E-benzyloxycarbonyl-lysyl]-threonyl-glycyl-prolyl)
FERINTOIC-ACID-A
PALTOLIDE_B
Integerrin
Butanamide, 2-(dimethylamino)-N-[7-(1H-indol-3-ylmethyl)-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methyl-, [3R-[3R*,4S*(S*),7S*]]-
DISCARIN-B
DISCASINE_B
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.