basic_info |
|
| Product_Name： | TRICHOTHECOLONE |
| CAS： | 2199-06-6 |
| EnglishSynonyms： | TRICHOTHECOLONE |
| pro_mdlNumber： | MFCD00078791 |
| pro_acceptors： | 4 |
| pro_donors： | 1 |
| pro_smile： | CC1=C[C@@H]2[C@](CC1=O)([C@]3([C@@H](C[C@H](C34CO4)O2)O)C)C |
| InChi： | InChI=1S/C15H20O4/c1-8-4-11-13(2,6-9(8)16)14(3)10(17)5-12(19-11)15(14)7-18-15/h4,10-12,17H,5-7H2,1-3H3/t10-,11-,12-,13+,14-,15?/m1/s1 |
| InChiKey： | InChIKey=BURHPZJXARNGQY-PYMBJFBLSA-N |
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