basic_info |
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| Product_Name: | 3-OXOURS-12-EN-28-OIC ACID |
| CAS: | 6246-46-4 |
| EnglishSynonyms: | URSONIC ACID ; 3-OXOURS-12-EN-28-OIC ACID |
| pro_mdlNumber: | MFCD09752413 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)[C@@H]2[C@H]1C)C)C(=O)O |
| InChi: | InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,24+,27+,28-,29-,30+/m1/s1 |
| InChiKey: | InChIKey=MUCRYNWJQNHDJH-OADIDDRXSA-N |
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