Chem
J-GLOBAL ID：200907074370161210   Nikkaji number：J486.484K

5,15-Bis[2-(acetylamino)phenyl]-10,20-bis[2-[(2,2-dimethylpropanoyl)amino]phenyl]-21H,23H-porphyrin

5,15-ビス[2-(アセチルアミノ)フェニル]-10,20-ビス[2-[(2,2-ジメチルプロパノイル)アミノ]フェニル]-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： C58H54N8O4
Molecular formula furigana： C58-H54-N8-O4
Molecular weight： 927.122
InChI： InChI=1S/C58H54N8O4/c1-33(67)59-39-21-13-9-17-35(39)51-43-25-29-47(61-43)53(37-19-11-15-23-41(37)65-55(69)57(3,4)5)49-31-27-45(63-49)52(36-18-10-14-22-40(36)60-34(2)68)46-28-32-50(64-46)54(48-30-26-44(51)62-48)38-20-12-16-24-42(38)66-56(70)58(6,7)8/h9-32,61,64H,1-8H3,(H,59,67)(H,60,68)(H,65,69)(H,66,70)/b51-43-,51-44-,52-45-,52-46-,53-47-,53-49-,54-48-,54-50-
InChI key： HJAKXKILOBEPII-QRBRRFLASA-N
SMILES： CC(=O)Nc1ccccc1/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccccc1NC(=O)C(C)(C)C)[nH]4)/c1ccccc1NC(=O)C)/C=C3)\c1ccccc1NC(=O)C(C)(C)C)/[nH]2
Systematic name  (3)：
  • 5,15-ビス[2-(アセチルアミノ)フェニル]-10,20-ビス[2-[(2,2-ジメチルプロパノイル)アミノ]フェニル]-21H,23H-ポルフィリン
  • N-(2-{12-[2-(2,2-ジメチルプロパンアミド)フェニル]-7,17-ビス(2-アセトアミドフェニル)-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-イル}フェニル)-2,2-ジメチルプロパンアミド
  • N-(2-{12-[2-(2,2-dimethylpropanamido)phenyl]-7,17-bis(2-acetamidophenyl)-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-undecaen-2-yl}phenyl)-2,2-dimethylpropanamide
Other name (1)：
  • 5,15-Bis[2-(acetylamino)phenyl]-10,20-bis[2-[(2,2-dimethylpropanoyl)amino]phenyl]-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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