basic_info |
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Product_Name: | 5,10,15,20-TETRA-PYREN-1-YL-PORPHYRIN |
EnglishSynonyms: | 5,10,15,20-TETRA-PYREN-1-YL-PORPHYRIN |
pro_mdlNumber: | MFCD09743586 |
pro_acceptors: | 4 |
pro_donors: | 0 |
pro_smile: | c1cc2ccc3ccc(c4c3c2c(c1)cc4)/c/5c/6\ccc(n6)/c(c\7/ccc(n7)/c(c\8/ccc(n8)/c(c\9/ccc5n9)/c1ccc2ccc3cccc4c3c2c1cc4)/c1ccc2ccc3cccc4c3c2c1cc4)/c1ccc2ccc3cccc4c3c2c1cc4 |
InChi: | InChI=1S/C84H44N4/c1-5-45-13-17-53-25-33-61(57-29-21-49(9-1)73(45)77(53)57)81-65-37-39-67(85-65)82(62-34-26-54-18-14-46-6-2-10-50-22-30-58(62)78(54)74(46)50)69-41-43-71(87-69)84(64-36-28-56-20-16-48-8-4-12-52-24-32-60(64)80(56)76(48)52)72-44-42-70(88-72)83(68-40-38-66(81)86-68)63-35-27-55-19-15-47-7-3-11-51-23-31-59(63)79(55)75(47)51/h1-44H/b81-65-,81-66-,82-67-,82-69-,83-68-,83-70-,84-71-,84-72- |
InChiKey: | InChIKey=QPCBDWJAIUUPQV-DINWVDFOSA-N |
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