basic_info |
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| Product_Name: | 4-(3,6-DIHYDROXY-10,13-DIMETHYL-2,3,6,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL)PENTANOIC ACID |
| CAS: | 106460-50-8 |
| EnglishSynonyms: | 4-(3,6-DIHYDROXY-10,13-DIMETHYL-2,3,6,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL)PENTANOIC ACID |
| pro_mdlNumber: | MFCD00277696 |
| pro_acceptors: | 4 |
| pro_donors: | 3 |
| pro_smile: | CC(CCC(=O)O)C1CCC2C1(CCC3C2C[C@@H](C4=C[C@@H](CCC34C)O)O)C |
| InChi: | InChI=1S/C24H38O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h12,14-19,21,25-26H,4-11,13H2,1-3H3,(H,27,28)/t14?,15-,16?,17?,18?,19?,21+,23?,24?/m1/s1 |
| InChiKey: | InChIKey=AJQRAPNIKHYNJX-WYEPJGGDSA-N |
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