4-[(2,4-diamino-7-keto-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl)methylamino]benzoic acid

SpectraBase Compound ID	KvgnOsvovP7
InChI	InChI=1S/C15H16N6O3/c16-11-10-5-8(13(22)20-12(10)21-15(17)19-11)6-18-9-3-1-7(2-4-9)14(23)24/h1-4,8,18H,5-6H2,(H,23,24)(H5,16,17,19,20,21,22)
InChIKey	HMJDMMBMQBFYEC-UHFFFAOYSA-N Google Search
Mol Weight	328.33 g/mol
Molecular Formula	C15H16N6O3
Exact Mass	328.128388 g/mol

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SpectraBase Spectrum ID	1UfzK4CI0yo
Name	4-[(2,4-diamino-7-keto-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl)methylamino]benzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H16N6O3
InChI	InChI=1S/C15H16N6O3/c16-11-10-5-8(13(22)20-12(10)21-15(17)19-11)6-18-9-3-1-7(2-4-9)14(23)24/h1-4,8,18H,5-6H2,(H,23,24)(H5,16,17,19,20,21,22)
InChIKey	HMJDMMBMQBFYEC-UHFFFAOYSA-N
Molecular Weight	328.332 g/mol
SMILES	N(c1ccc(C(=O)O)cc1)CC1Cc2c(nc(nc2NC1=O)N)N
SPLASH	splash10-0006-0900000000-1e22e6448f68a29c0e4c
Source of Spectrum	F2-41-3544-14
Synonyms	4-[(2,4-diamino-7-oxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl)methylamino]benzoic acid 4-[[2,4-bis(azanyl)-7-oxidanylidene-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]methylamino]benzoic acid
Wiley ID	1599729