basic_info |
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| Product_Name: | 4-[(4BETA,5BETA,10ALPHA)-ABIETA-8,11,13-TRIEN-19-YL]-1,2,4-TRIAZOLIDINE-3,5-DIONE |
| EnglishSynonyms: | 4-[(4BETA,5BETA,10ALPHA)-ABIETA-8,11,13-TRIEN-19-YL]-1,2,4-TRIAZOLIDINE-3,5-DIONE |
| pro_mdlNumber: | MFCD09867750 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | CC(C)c1ccc2c(c1)CC[C@H]3[C@]2(CCC[C@]3(C)Cn4c(=O)[nH][nH]c4=O)C |
| InChi: | InChI=1S/C22H31N3O2/c1-14(2)15-6-8-17-16(12-15)7-9-18-21(3,10-5-11-22(17,18)4)13-25-19(26)23-24-20(25)27/h6,8,12,14,18H,5,7,9-11,13H2,1-4H3,(H,23,26)(H,24,27)/t18-,21-,22+/m1/s1 |
| InChiKey: | InChIKey=WYQACVQVYYIZIW-QIJUGHKUSA-N |
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