Chem
J-GLOBAL ID：201207072405145037   Nikkaji number：J3.061.096B

4-Methoxy-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-methoxy-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol

4-メトキシ-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-メトキシ-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]フェノール
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： C45H54N6O6
Molecular formula furigana： C45-H54-N6-O6
Molecular weight： 774.963
InChI： InChI=1S/C45H54N6O6/c1-55-34-16-28-22-46-37-10-4-6-12-39(37)48-24-30-18-35(56-2)20-32(44(30)53)26-50-41-14-8-9-15-42(41)51-27-33-21-36(57-3)19-31(45(33)54)25-49-40-13-7-5-11-38(40)47-23-29(17-34)43(28)52/h16-27,37-42,52-54H,4-15H2,1-3H3/t37-,38-,39-,40-,41-,42-/m0/s1
InChI key： LJJJDSNXHKNEBA-UJKKYYSESA-N
SMILES： COc1cc2C=N[C@H]3CCCC[C@@H]3N=Cc3cc(OC)cc(C=N[C@H]4CCCC[C@@H]4N=Cc4cc(OC)cc(C=N[C@H]5CCCC[C@@H]5N=Cc(c1)c2O)c4O)c3O
Systematic name  (3)：
  • 4-メトキシ-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-メトキシ-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]フェノール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-トリメトキシ-3,10,18,25,33,40-ヘキサアザヘプタシクロ[40.3.1.112,16.127,31.04,9.019,24.034,39]オクタテトラコンタ-1(46),2,10,12,14,16(48),17,25,27,29,31(47),32,40,42,44-ペンタデカエン-46,47,48-トリオール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-trimethoxy-3,10,18,25,33,40-hexaazaheptacyclo[40.3.1.112,16.127,31.04,9.019,24.034,39]octatetraconta-1(46),2,10,12,14,16(48),17,25,27,29,31(47),32,40,42,44-pentadecaene-46,47,48-triol
Other name (1)：
  • 4-Methoxy-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-methoxy-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol
Thsaurus map：
Thesaurus Map

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