Chem
J-GLOBAL ID：200907064590670721   Nikkaji number：J2.216.747B

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

5,10-ビス[4-(オクタデシルオキシ)フェニル]-15,20-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)79-73-55-53-71(84-73)77(61-35-39-65(40-36-61)81(87)88)69-51-52-70(83-69)78(62-37-41-66(42-38-62)82(89)90)72-54-56-74(85-72)80(76-58-57-75(79)86-76)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/h35-58,84-85H,3-34,59-60H2,1-2H3,(H,87,88)(H,89,90)/b77-69-,77-71-,78-70-,78-72-,79-73-,79-75-,80-74-,80-76-
InChI key： SMQZWSFVJYTVOS-IXFMMASFSA-N
SMILES： CCCCCCCCCCCCCCCCCCOc1ccc(cc1)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccc(OCCCCCCCCCCCCCCCCCC)cc1)[nH]4)/c1ccc(cc1)C(=O)O)/C=C3)\c1ccc(cc1)C(=O)O)/[nH]2
Systematic name  (3)：
  • 5,10-ビス[4-(オクタデシルオキシ)フェニル]-15,20-ビス(4-カルボキシフェニル)-21H,23H-ポルフィリン
  • 4-[17-(4-カルボキシフェニル)-7,12-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-[17-(4-carboxyphenyl)-7,12-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)：
  • 5,10-Bis[4-(octadecyloxy)phenyl]-15,20-bis(4-carboxyphenyl)-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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