basic_info |
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| Product_Name: | 硫胺噻唑酮焦磷酸酯 |
| CAS: | 59733-97-0 |
| 中文同义词: | 硫胺噻唑酮焦磷酸酯 ; 2-[3-[(4-氨基-2-甲基嘧啶-5-基)甲基]-4-甲基-2-氧代-1,3-噻唑-5-基]乙基焦磷酸酯 |
| EnglishSynonyms: | 2-[3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-1,3-THIAZOL-5-YL]ETHYL PHOSPHONO HYDROGEN PHOSPHATE ; THIAMINE THIAZOLONE PYROPHOSPHATE |
| pro_mdlNumber: | MFCD13194924 |
| pro_acceptors: | 12 |
| pro_donors: | 4 |
| pro_smile: | Cc1c(sc(=O)n1Cc2cnc(nc2N)C)CCOP(=O)(O)OP(=O)(O)O |
| InChi: | InChI=1S/C12H18N4O8P2S/c1-7-10(3-4-23-26(21,22)24-25(18,19)20)27-12(17)16(7)6-9-5-14-8(2)15-11(9)13/h5H,3-4,6H2,1-2H3,(H,21,22)(H2,13,14,15)(H2,18,19,20) |
| InChiKey: | InChIKey=ZGJUYGIRPQSCFA-UHFFFAOYSA-N |
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