Chem
J-GLOBAL ID：200907013517698789   Nikkaji number：J1.960.357A

5,10,15,20-Tetra(6-azulenyl)-21H,23H-porphyrin

5,10,15,20-テトラ(6-アズレニル)-21H,23H-ポルフィリン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C60H38N4
Molecular formula furigana： C60-H38-N4
Molecular weight： 814.992
InChI： InChI=1S/C60H38N4/c1-5-37-13-21-45(22-14-38(37)6-1)57-49-29-31-51(61-49)58(46-23-15-39-7-2-8-40(39)16-24-46)53-33-35-55(63-53)60(48-27-19-43-11-4-12-44(43)20-28-48)56-36-34-54(64-56)59(52-32-30-50(57)62-52)47-25-17-41-9-3-10-42(41)18-26-47/h1-36,61,64H/b57-49-,57-50-,58-51-,58-53-,59-52-,59-54-,60-55-,60-56-
InChI key： XUCFFFMMWSPXBC-NWQHMXIBSA-N
SMILES： c1cc2ccc(ccc2c1)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccc5cccc5cc1)[nH]4)/c1ccc4cccc4cc1)/C=C3)\c1ccc3cccc3cc1)/[nH]2
Systematic name  (3)：
  • 5,10,15,20-テトラ(6-アズレニル)-21H,23H-ポルフィリン
  • 2,7,12,17-テトラキス(アズレン-6-イル)-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン
  • 2,7,12,17-tetrakis(azulen-6-yl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene
Other name (1)：
  • 5,10,15,20-Tetra(6-azulenyl)-21H,23H-porphyrin
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