basic_info |
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| Product_Name: | MESO-TETRA (N-METHYL-3-PYRIDYL) PORPHINE TETRACHLORIDE |
| CAS: | 94343-62-1 |
| EnglishSynonyms: | MESO-TETRA (N-METHYL-3-PYRIDYL) PORPHINE TETRACHLORIDE ; 5,10,15,20-TETRAKIS-(N-METHYL-3-PYRIDYL)-21,23H-PORPHYRIN TETRACHLORIDE |
| pro_mdlNumber: | MFCD09039052 |
| pro_acceptors: | 8 |
| pro_donors: | 2 |
| pro_smile: | C[n+]1cccc(c1)/c2/c3ccc([nH]3)/c(c/4\nc(/c(c\5/cc/c(/[nH]5)c(/c6n\c2\C=C6)\c7ccc[n+](c7)C)/c8ccc[n+](c8)C)C=C4)/c9ccc[n+](c9)C.[Cl-].[Cl-].[Cl-].[Cl-] |
| InChi: | InChI=1S/C44H38N8.4ClH/c1-49-21-5-9-29(25-49)41-33-13-15-35(45-33)42(30-10-6-22-50(2)26-30)37-17-19-39(47-37)44(32-12-8-24-52(4)28-32)40-20-18-38(48-40)43(36-16-14-34(41)46-36)31-11-7-23-51(3)27-31;;;;/h5-28,45,48H,1-4H3;4*1H/q+4;;;;/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;;; |
| InChiKey: | InChIKey=XEQRJEQOYUDRPQ-GVHKZQBISA-J |
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