basic_info |
|
| Product_Name： | OTAVA-FLUOR OTVD_0206 |
| EnglishSynonyms： | OTAVA-FLUOR OTVD_0206 |
| pro_mdlNumber： | MFCD10001167 |
| pro_acceptors： | 5 |
| pro_donors： | 1 |
| pro_smile： | CC1=CC(=Cc2[n+](c3ccccc3s2)C)C=C(N1CCCCCC(=O)NCCN(C)C)C.[O-]Cl(=O)(=O)=O |
| InChi： | InChI=1S/C26H36N4OS.ClHO4/c1-20-17-22(19-26-29(5)23-11-8-9-12-24(23)32-26)18-21(2)30(20)15-10-6-7-13-25(31)27-14-16-28(3)4;2-1(3,4)5/h8-9,11-12,17-19H,6-7,10,13-16H2,1-5H3;(H,2,3,4,5) |
| InChiKey： | InChIKey=STHBBSVTNOONNO-UHFFFAOYSA-N |
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