basic_info |
|
| Product_Name: | 分支酸钡盐 |
| CAS: | 55508-12-8 |
| 中文同义词: | 分支酸钡盐 |
| EnglishSynonyms: | CHORISMIC ACID BARIUM SALT ; TRANS-3-([1-CARBOXYETHENYL]OXY)-4-HYDROXY-1,5-CYCLOHEXADIENE-1-CARBOXYLIC ACID BARIUM SALT |
| pro_mdlNumber: | MFCD00075702 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | C=C1C(=O)O[Ba]OC(=O)C2=C[C@@H](O1)[C@@H](C=C2)O |
| InChi: | InChI=1S/C10H10O6.Ba/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11;/h2-4,7-8,11H,1H2,(H,12,13)(H,14,15);/q;+2/p-2/t7-,8-;/m1./s1 |
| InChiKey: | InChIKey=JZEDEBJYKXCJNO-SCLLHFNJSA-L |
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