basic_info |
|
| Product_Name： | BARIUM ABIETATE |
| EnglishSynonyms： | BARIUM ABIETATE |
| pro_mdlNumber： | MFCD07783124 |
| pro_acceptors： | 4 |
| pro_donors： | 0 |
| pro_smile： | CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O[Ba]OC(=O)[C@@]4(CCC[C@]5([C@H]4CC=C6[C@@H]5CCC(=C6)C(C)C)C)C)C |
| InChi： | InChI=1S/2C20H30O2.Ba/c2*1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h2*7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);/q;;+2/p-2/t2*16-,17+,19+,20+;/m00./s1 |
| InChiKey： | InChIKey=ZQGVSNSRNASLMU-JHZYRPMRSA-L |
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