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AMETHOPTERIDINE
SpectraBase Compound ID 2YU5mzHST1R
InChI InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)
InChIKey FBOZXECLQNJBKD-UHFFFAOYSA-N
Mol Weight 454.45 g/mol
Molecular Formula C20H22N8O5
Exact Mass 454.171316 g/mol
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique DI/MS
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum NP-19-263-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W5-0-0-0
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 194697
Technique Mull
Copyright Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 194697
  • METHOTREXATE;N-(4-(((2,4-DIAMINO-6-PTERIDINYL)-METHYL)-METHYLAMINO)-BENZOYL)-L-GLUTAMIC-ACID
  • DL-amethopterin hydrate
  • N-(4-[[(2,4-Diamino-6-pteridinyl)methyl](methyl)amino]benzoyl)glutamic acid
  • Methotrexat
  • Amethopterin
  • (2R)-2-[[4-[(2,4-Diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioic acid
Title Journal or Book Year
1H and13C NMR relaxation investigation of methotrexate in [2H6]dimethyl sulphoxide solution Magnetic Resonance in Chemistry 1993
Anwendungen der 13 C‐Resonanz‐Spektroskopie, XI. Pteridin‐Spektren, I Chemische Berichte 1973

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