Chem
J-GLOBAL ID：200907064530308454   Nikkaji number：J2.216.748K

5,15-Bis[4-(octadecyloxy)phenyl]-10,20-bis(4-carboxyphenyl)-21H,23H-porphyrin

5,15-ビス[4-(オクタデシルオキシ)フェニル]-10,20-ビス(4-カルボキシフェニル)-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： C82H102N4O6
Molecular formula furigana： C82-H102-N4-O6
Molecular weight： 1239.740
InChI： InChI=1S/C82H102N4O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-59-91-67-47-43-63(44-48-67)79-73-55-51-69(83-73)77(61-35-39-65(40-36-61)81(87)88)71-53-57-75(85-71)80(76-58-54-72(86-76)78(70-52-56-74(79)84-70)62-37-41-66(42-38-62)82(89)90)64-45-49-68(50-46-64)92-60-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-58,83,86H,3-34,59-60H2,1-2H3,(H,87,88)(H,89,90)/b77-69-,77-71-,78-70-,78-72-,79-73-,79-74-,80-75-,80-76-
InChI key： LYJCJCGBNBCZKY-KLWGUPCVSA-N
SMILES： CCCCCCCCCCCCCCCCCCOc1ccc(cc1)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccc(cc1)C(=O)O)[nH]4)/c1ccc(OCCCCCCCCCCCCCCCCCC)cc1)/C=C3)\c1ccc(cc1)C(=O)O)/[nH]2
Systematic name  (3)：
  • 5,15-ビス[4-(オクタデシルオキシ)フェニル]-10,20-ビス(4-カルボキシフェニル)-21H,23H-ポルフィリン
  • 4-[12-(4-カルボキシフェニル)-7,17-ビス[4-(オクタデシルオキシ)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]安息香酸
  • 4-[12-(4-carboxyphenyl)-7,17-bis[4-(octadecyloxy)phenyl]-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]benzoic acid
Other name (1)：
  • 5,15-Bis[4-(octadecyloxy)phenyl]-10,20-bis(4-carboxyphenyl)-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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