basic_info |
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| Product_Name: | b-D-葡萄-六二醛-1,5-吡喃糖,S-苯基单硫代半缩醛, 五乙酸酯, (S)- (9CI) |
| CAS: | 304853-30-3 |
| 中文同义词: | b-D-葡萄-六二醛-1,5-吡喃糖,S-苯基单硫代半缩醛, 五乙酸酯, (S)- (9CI) |
| EnglishSynonyms: | 3-(4,4-DIMETHYL-2-OXO-2,4-DIHYDRO-1H-BENZO[D][1,3]OXAZIN-6-YL)-5-FLUOROBENZONITRILE |
| pro_mdlNumber: | MFCD08234455 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | CC1(c2cc(ccc2NC(=O)O1)c3cc(cc(c3)F)C#N)C |
| InChi: | InChI=1S/C17H13FN2O2/c1-17(2)14-8-11(3-4-15(14)20-16(21)22-17)12-5-10(9-19)6-13(18)7-12/h3-8H,1-2H3,(H,20,21) |
| InChiKey: | InChIKey=KVMSWMUZFCLLFV-UHFFFAOYSA-N |
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