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(2S)-2-[[4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo-[2,3-D]-pyrimidin-5-yl)-ethyl]-benzoyl]-amino]-pentanedioic-acid-1-ethylester

Compound with spectra: 2 NMR

(2S)-2-[[4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo-[2,3-D]-pyrimidin-5-yl)-ethyl]-benzoyl]-amino]-pentanedioic-acid-1-ethylester
SpectraBase Compound ID DqQ6sa3XmdI
InChI InChI=1S/C22H25N5O6/c1-2-33-21(32)15(9-10-16(28)29)25-19(30)13-6-3-12(4-7-13)5-8-14-11-24-18-17(14)20(31)27-22(23)26-18/h3-4,6-7,11,15H,2,5,8-10H2,1H3,(H,25,30)(H,28,29)(H4,23,24,26,27,31)/t15-/m0/s1
InChIKey RDFCBNQHUWRWRC-HNNXBMFYSA-N
Mol Weight 455.47 g/mol
Molecular Formula C22H25N5O6
Exact Mass 455.180484 g/mol
Enantiomer InChIKey RDFCBNQHUWRWRC-OAHLLOKOSA-N
Racemate InChIKey RDFCBNQHUWRWRC-UHFFFAOYSA-N

View Spectrum of (2S)-2-[[4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo-[2,3-D]-pyrimidin-5-yl)-ethyl]-benzoyl]-amino]-pentanedioic-acid-1-ethylester

13C NMR Spectrum
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View Spectrum of (2S)-2-[[4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo-[2,3-D]-pyrimidin-5-yl)-ethyl]-benzoyl]-amino]-pentanedioic-acid-1-ethylester

15N NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
(2S)-2-[[4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo-[2,3-D]-pyrimidin-5-yl)-ethyl]-benzoyl]-amino]-pentanedioic-acid-5-ethylester
4-{1-[2-Amino-4-hydroxypyrido[2,3-d]pyrimidin-5-yl]methylamino}benzoyl-L-glutamic acid
2-Amino-4-hydroxy-5-(2'-phenethyl)-5-methylpyrrolo[2,3-d]pyrimidine
(2S)-2-[[4-[[(4-keto-6-methyl-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-yl)amino]methyl]benzoyl]amino]glutaric acid diethyl ester
Diethyl N-{4-[2-(2,4-Diaminopyrido[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamate
Dimethyl N-{4-[2-(2-Methyl-4-hydroxy thieno[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamate
METHYL-2-AMINO-3-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4-ONE-5-CARBOXYLATE
Dimethyl N-{4-[2-(2,4-Diaminothieno[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamate
Dimethyl N-{4-[2-(4-Amino-2-methylthieno[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamate
7-CYANO-9-(2-HYDROXYETHYL)-7-DEAZAGUANINE
Title Journal or Book Year
Synthesis and Physicochemical Characterization of the Impurities of Pemetrexed Disodium, an Anticancer Drug Molecules 2015
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