Chem
J-GLOBAL ID:200907072153479659   Nikkaji number:J1.476.046F

5-(2,2′-Bipyridine-5-yl)-11,17,23,29-tetramethylhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecene-31,32,33,34,35-pentol

5-(2,2′-ビピリジン-5-イル)-11,17,23,29-テトラメチルヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン-31,32,33,34,35-ペンタオール
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: C49H44N2O5
Molecular formula furigana: C49-H44-N2-O5
Molecular weight: 740.900
InChI: InChI=1S/C49H44N2O5/c1-27-11-33-21-34-12-28(2)14-36(46(34)53)23-38-16-30(4)18-40(48(38)55)25-42-20-32(31-8-9-44(51-26-31)43-7-5-6-10-50-43)19-41(49(42)56)24-39-17-29(3)15-37(47(39)54)22-35(13-27)45(33)52/h5-20,26,52-56H,21-25H2,1-4H3
InChI key: CULMPSXPSRUUDC-UHFFFAOYSA-N
SMILES: Cc1cc2Cc3cc(C)cc(Cc4cc(C)cc(Cc5cc(cc(Cc6cc(C)cc(Cc(c1)c2O)c6O)c5O)c1ccc(nc1)c1ccccn1)c4O)c3O
Systematic name  (3):
  • 5-(2,2′-ビピリジン-5-イル)-11,17,23,29-テトラメチルヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン-31,32,33,34,35-ペンタオール
  • 5-{[2,2'-ビピリジン]-5-イル}-11,17,23,29-テトラメチルヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン-31,32,33,34,35-ペンタオール
  • 5-{[2,2'-bipyridin]-5-yl}-11,17,23,29-tetramethylhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaene-31,32,33,34,35-pentol
Other name (1):
  • 5-(2,2′-Bipyridine-5-yl)-11,17,23,29-tetramethylhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecene-31,32,33,34,35-pentol
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