basic_info |
|
| Product_Name: | OXYTETRACYCLINE CALCIUM |
| CAS: | 7179-50-2 |
| EnglishSynonyms: | OXYTETRACYCLINE CALCIUM |
| pro_mdlNumber: | MFCD01747636 |
| pro_acceptors: | 11 |
| pro_donors: | 5 |
| pro_smile: | C[C@@]12c3cccc(c3C(=O)C4=C([C@]5([C@@H](C([C@@H]41)O[Ca]O2)[C@@H](C(=C(C5=O)C(=O)N)O)N(C)C)O)O)O |
| InChi: | InChI=1S/C22H22N2O9.Ca/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29;/h4-6,12-14,17,25,27,29,33H,1-3H3,(H2,23,31);/q-2;+2/t12-,13-,14+,17?,21-,22+;/m1./s1 |
| InChiKey: | InChIKey=ACVUAPSMTUEGNO-IRAQRLPQSA-N |
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