Chem
J-GLOBAL ID：200907046351996064   Nikkaji number：J1.068.126J

3,7,13,17-Tetramethyl-2,8,12,18-tetraethyl-5,15-bis[2-(octanoylamino)phenyl]-21H,23H-porphyrin

3,7,13,17-テトラメチル-2,8,12,18-テトラエチル-5,15-ビス[2-(オクタノイルアミノ)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： C60H76N6O2
Molecular formula furigana： C60-H76-N6-O2
Molecular weight： 913.308
InChI： InChI=1S/C60H76N6O2/c1-11-17-19-21-23-33-53(67)61-47-31-27-25-29-45(47)55-57-37(7)41(13-3)49(63-57)35-51-43(15-5)39(9)59(65-51)56(46-30-26-28-32-48(46)62-54(68)34-24-22-20-18-12-2)60-40(10)44(16-6)52(66-60)36-50-42(14-4)38(8)58(55)64-50/h25-32,35-36,63,66H,11-24,33-34H2,1-10H3,(H,61,67)(H,62,68)/b49-35-,50-36-,51-35-,52-36-,57-55-,58-55-,59-56-,60-56-
InChI key： VHRJICVPMHXKMG-ARCJIPGZSA-N
SMILES： CCCCCCCC(=O)Nc1ccccc1/C/1=c\2/[nH]/c(=C\C3=N/C(=C(\c4[nH]c(/C=C/5\N=C1C(=C5CC)C)c(c4C)CC)/c1ccccc1NC(=O)CCCCCCC)/C(=C3CC)C)/c(c2C)CC
Systematic name  (3)：
  • 3,7,13,17-テトラメチル-2,8,12,18-テトラエチル-5,15-ビス[2-(オクタノイルアミノ)フェニル]-21H,23H-ポルフィリン
  • N-{2-[5,9,15,19-テトラエチル-4,10,14,20-テトラメチル-12-(2-オクタンアミドフェニル)-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(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2-イル]フェニル}オクタンアミド
  • N-{2-[5,9,15,19-tetraethyl-4,10,14,20-tetramethyl-12-(2-octanamidophenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}octanamide
Other name (1)：
  • 3,7,13,17-Tetramethyl-2,8,12,18-tetraethyl-5,15-bis[2-(octanoylamino)phenyl]-21H,23H-porphyrin
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Thesaurus Map

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