甲氨蝶呤钠 ,7532-04-9 _ChemCD

甲氨蝶呤钠

basic_info
Product_Name：	甲氨蝶呤钠
CAS：	7532-04-9 ;15475-56-6
中文同义词：	甲氨蝶呤钠
EnglishSynonyms：	SODIUM (S)-4-CARBOXY-2-(4-(((2,4-DIAMINOPTERIDIN-6-YL)METHYL)(METHYL)AMINO)BENZAMIDO)BUTANOATE ; METHOTREXATE SODIUM ; SODIUM 2,4-DIAMINO-6-[[(4-[[(1S)-1-CARBOXY-3-CARBOXYLATOPROPYL]CARBAMOYL]PHENYL)(METHYL)AMINO]METHYL]PTERIDINE
pro_mdlNumber：	MFCD06636701
pro_acceptors：	13
pro_donors：	4
pro_smile：	CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)[O-].[Na+]
InChi：	InChI=1S/C20H22N8O5.Na/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);/q;+1/p-1/t13-;/m0./s1
InChiKey：	InChIKey=BKBBTCORRZMASO-ZOWNYOTGSA-M

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