basic_info |
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Product_Name: | 苯甲酸,2-甲基-4-(4-吡啶基)- |
CAS: | 83997-16-4 |
中文同义词: | 苯甲酸,2-甲基-4-(4-吡啶基)- |
EnglishSynonyms: | (S)-D-PHENYLALANYL-N-(4-((AMINOIMINOMETHYL)AMINO)-1-FORMYLBUTYL)-L-PRO LINAMIDE SULFATE (1:1) |
pro_mdlNumber: | MFCD01698834 |
pro_acceptors: | 9 |
pro_donors: | 5 |
pro_smile: | c1ccc(cc1)C[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C=O)N.OS(=O)(=O)O |
InChi: | InChI=1S/C20H30N6O3.H2O4S/c21-16(12-14-6-2-1-3-7-14)19(29)26-11-5-9-17(26)18(28)25-15(13-27)8-4-10-24-20(22)23;1-5(2,3)4/h1-3,6-7,13,15-17H,4-5,8-12,21H2,(H,25,28)(H4,22,23,24);(H2,1,2,3,4)/t15-,16+,17-;/m0./s1 |
InChiKey: | InChIKey=WQNNDABHYSXCLU-VNMUXGFYSA-N |
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