basic_info |
|
| Product_Name： | FRAGMENTA PYR421 |
| EnglishSynonyms： | FRAGMENTA PYR421 |
| pro_mdlNumber： | MFCD23380801 |
| pro_acceptors： | 5 |
| pro_donors： | 0 |
| pro_smile： | CCCCC[n+]1cccc(c1)C(=O)Oc2ccc(cc2OC)C=O.[Cl-] |
| InChi： | InChI=1S/C19H22NO4.ClH/c1-3-4-5-10-20-11-6-7-16(13-20)19(22)24-17-9-8-15(14-21)12-18(17)23-2;/h6-9,11-14H,3-5,10H2,1-2H3;1H/q+1;/p-1 |
| InChiKey： | InChIKey=MERQJUIBZYRPFE-UHFFFAOYSA-M |
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