basic_info |
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Product_Name: | Pelitrexol |
CAS: | 446022-33-9 |
中文同义词: | Pelitrexol ; N-((5-(2-((6S)-2-氨基-1,4,5,6,7,8-六氢-4-氧代吡啶并[2,3-d]嘧啶-6-基)乙基)-4-甲基-2-噻吩)甲酰基)-L-谷氨酸 |
EnglishSynonyms: | PELITREXOL |
pro_mdlNumber: | MFCD13194949 |
pro_acceptors: | 11 |
pro_donors: | 6 |
pro_smile: | Cc1cc(sc1CC[C@H]2Cc3c([nH]c(nc3=O)N)NC2)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
InChi: | InChI=1S/C20H25N5O6S/c1-9-6-14(18(29)23-12(19(30)31)3-5-15(26)27)32-13(9)4-2-10-7-11-16(22-8-10)24-20(21)25-17(11)28/h6,10,12H,2-5,7-8H2,1H3,(H,23,29)(H,26,27)(H,30,31)(H4,21,22,24,25,28)/t10-,12-/m0/s1 |
InChiKey: | InChIKey=QXOPTIPQEVJERB-JQWIXIFHSA-N |
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