basic_info |
|
| Product_Name： | COUMETAROL |
| CAS： | 4366-18-1 |
| EnglishSynonyms： | COUMETAROL |
| pro_mdlNumber： | MFCD00865269 |
| pro_acceptors： | 7 |
| pro_donors： | 2 |
| pro_smile： | COCC(c1c(c2ccccc2oc1=O)O)c3c(c4ccccc4oc3=O)O |
| InChi： | InChI=1S/C21H16O7/c1-26-10-13(16-18(22)11-6-2-4-8-14(11)27-20(16)24)17-19(23)12-7-3-5-9-15(12)28-21(17)25/h2-9,13,22-23H,10H2,1H3 |
| InChiKey： | InChIKey=BUCJFFQZPGTGPX-UHFFFAOYSA-N |
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