Chem
J-GLOBAL ID：200907059660925524   Nikkaji number：J2.394.354I

1-[2-Hydroxy-3-[[(1R,2R)-2-[2-hydroxy-3-(piperidinomethyl)-5-tert-butylbenzylideneamino]cyclohexyl]iminomethyl]-5-tert-butylbenzyl]piperidinium

1-[2-ヒドロキシ-3-[[(1R,2R)-2-[2-ヒドロキシ-3-(ピペリジノメチル)-5-tert-ブチルベンジリデンアミノ]シクロヘキシル]イミノメチル]-5-tert-ブチルベンジル]ピペリジニウム
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： C40H61N3[N+]O2
Molecular formula furigana： C40-H61-N4-O2
Molecular weight： 629.953
InChI： InChI=1S/C40H60N4O2/c1-39(2,3)33-21-29(37(45)31(23-33)27-43-17-11-7-12-18-43)25-41-35-15-9-10-16-36(35)42-26-30-22-34(40(4,5)6)24-32(38(30)46)28-44-19-13-8-14-20-44/h21-26,35-36,45-46H,7-20,27-28H2,1-6H3/p+1/t35-,36-/m1/s1
InChI key： QWZFCHMBYWXSLV-LQFQNGICSA-O
SMILES： CC(C)(C)c1cc(CN2CCCCC2)c(O)c(C=N[C@@H]2CCCC[C@H]2N=Cc2cc(cc(C[NH+]3CCCCC3)c2O)C(C)(C)C)c1
Systematic name  (4)：
  • 1-[3-[[(1R,2R)-2-[[2-ヒドロキシ-3-(ピペリジノメチル)-5-tert-ブチルベンジリデン]アミノ]シクロヘキシル]イミノメチル]-2-ヒドロキシ-5-tert-ブチルベンジル]ピペリジニウム
  • 1-[2-ヒドロキシ-3-[[(1R,2R)-2-[2-ヒドロキシ-3-(ピペリジノメチル)-5-tert-ブチルベンジリデンアミノ]シクロヘキシル]イミノメチル]-5-tert-ブチルベンジル]ピペリジニウム
  • 1-{[5-tert-ブチル-3-({[(1R,2R)-2-[({5-tert-ブチル-2-ヒドロキシ-3-[(ピペリジン-1-イル)メチル]フェニル}メチリデン)アミノ]シクロヘキシル]イミノ}メチル)-2-ヒドロキシフェニル]メチル}ピペリジン-1-イウム
  • 1-{[5-tert-butyl-3-({[(1R,2R)-2-[({5-tert-butyl-2-hydroxy-3-[(piperidin-1-yl)methyl]phenyl}methylidene)amino]cyclohexyl]imino}methyl)-2-hydroxyphenyl]methyl}piperidin-1-ium
Other name (2)：
  • 1-[3-[[(1R,2R)-2-[[2-Hydroxy-3-(piperidinomethyl)-5-tert-butylbenzylidene]amino]cyclohexyl]iminomethyl]-2-hydroxy-5-tert-butylbenzyl]piperidinium
  • 1-[2-Hydroxy-3-[[(1R,2R)-2-[2-hydroxy-3-(piperidinomethyl)-5-tert-butylbenzylideneamino]cyclohexyl]iminomethyl]-5-tert-butylbenzyl]piperidinium
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM