basic_info |
|
| Product_Name： | SCIRPENTRIOL |
| CAS： | 2270-41-9 |
| EnglishSynonyms： | SCIRPENTRIOL |
| pro_mdlNumber： | MFCD00078762 |
| pro_acceptors： | 5 |
| pro_donors： | 3 |
| pro_smile： | CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO |
| InChi： | InChI=1S/C15H22O5/c1-8-3-4-14(6-16)9(5-8)20-12-10(17)11(18)13(14,2)15(12)7-19-15/h5,9-12,16-18H,3-4,6-7H2,1-2H3/t9-,10-,11-,12-,13-,14-,15?/m1/s1 |
| InChiKey： | InChIKey=PXEBOIUZEXXBGH-WUCLZUGASA-N |
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