basic_info |
|
| Product_Name: | 3-ALPHA-HYDROXY-6-BETA,7-BETA-EPOXY-CANRENONE |
| CAS: | 114577-02-5 |
| EnglishSynonyms: | 3-ALPHA-HYDROXY-6-BETA,7-BETA-EPOXY-CANRENONE |
| pro_mdlNumber: | MFCD01698941 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | C[C@]12CC[C@H](C=C1[C@H]3[C@H](O3)[C@@H]4[C@@H]2CC[C@]5([C@H]4CC[C@]56CCC(=O)O6)C)O |
| InChi: | InChI=1S/C22H30O4/c1-20-7-3-12(23)11-15(20)18-19(25-18)17-13(20)4-8-21(2)14(17)5-9-22(21)10-6-16(24)26-22/h11-14,17-19,23H,3-10H2,1-2H3/t12-,13+,14+,17-,18+,19-,20-,21+,22+/m1/s1 |
| InChiKey: | InChIKey=XQXVYVWEJOZZCR-FRKBCXHCSA-N |
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