basic_info |
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| Product_Name: | 1,3,5(10)-ESTRATRIEN-2,4-DIBROMO-3,17-BETA-DIOL |
| CAS: | 19590-55-7 |
| EnglishSynonyms: | 1,3,5(10)-ESTRATRIEN-2,4-DIBROMO-3,17-BETA-DIOL ; 2,4-DIBROMOESTRADIOL |
| pro_mdlNumber: | MFCD00271664 |
| pro_acceptors: | 2 |
| pro_donors: | 2 |
| pro_smile: | C[C@]12CC[C@@H]3c4cc(c(c(c4CC[C@H]3[C@@H]1CC[C@@H]2O)Br)O)Br |
| InChi: | InChI=1S/C18H22Br2O2/c1-18-7-6-9-10(13(18)4-5-15(18)21)2-3-11-12(9)8-14(19)17(22)16(11)20/h8-10,13,15,21-22H,2-7H2,1H3/t9-,10+,13-,15-,18-/m0/s1 |
| InChiKey: | InChIKey=UTXNYGUZJLLOSP-ZICKVNAASA-N |
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