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4-{1-[2-Amino-4-hydroxypyrido[2,3-d]pyrimidin-5-yl]methylamino}benzoyl-L-glutamic acid
SpectraBase Compound ID ImGF6jE07gl
InChI InChI=1S/C20H20N6O6/c21-20-25-16-15(18(30)26-20)11(7-8-22-16)9-23-12-3-1-10(2-4-12)17(29)24-13(19(31)32)5-6-14(27)28/h1-4,7-8,13,23H,5-6,9H2,(H,24,29)(H,27,28)(H,31,32)(H3,21,22,25,26,30)
InChIKey YDUBYTWRLPSUNF-UHFFFAOYSA-N
Mol Weight 440.42 g/mol
Molecular Formula C20H20N6O6
Exact Mass 440.144432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7PJwYkKydn4
Name 4-{1-[2-Amino-4-hydroxypyrido[2,3-d]pyrimidin-5-yl]methylamino}benzoyl-L-glutamic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N6O6
InChI InChI=1S/C20H20N6O6/c21-20-25-16-15(18(30)26-20)11(7-8-22-16)9-23-12-3-1-10(2-4-12)17(29)24-13(19(31)32)5-6-14(27)28/h1-4,7-8,13,23H,5-6,9H2,(H,24,29)(H,27,28)(H,31,32)(H3,21,22,25,26,30)
InChIKey YDUBYTWRLPSUNF-UHFFFAOYSA-N
Molecular Weight 440.416 g/mol
SMILES N(Cc1c2c(N=C(NC2=O)N)ncc1)c1ccc(C(NC(CCC(=O)O)C(=O)O)=O)cc1
SPLASH splash10-03di-0900000000-8bfb1aab779802b4c32a
Source of Spectrum H1-48-2154-4
Synonyms 4-{1-[2-Amino-4-hydroxypyrido[2,3-d]pyrimidin-5-yl]methylamino}benzoyl-L-glutamate N-(4-{[(2-amino-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-5-yl)methyl]amino}benzoyl)glutamic acid
Wiley ID 816640