Chem
J-GLOBAL ID：200907048232156220   Nikkaji number：J922.075E

(9S)-1-(9-Anthrylmethyl)-9-hydroxycinchonan-1-ium

(9S)-1-(9-アントリルメチル)-9-ヒドロキシシンコナン-1-イウム
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： C34H33N[N+]O
Molecular formula furigana： C34-H33-N2-O
Molecular weight： 485.650
InChI： InChI=1S/C34H33N2O/c1-2-23-21-36(22-31-27-11-5-3-9-25(27)19-26-10-4-6-12-28(26)31)18-16-24(23)20-33(36)34(37)30-15-17-35-32-14-8-7-13-29(30)32/h2-15,17,19,23-24,33-34,37H,1,16,18,20-22H2/q+1/t23-,24-,33+,34-,36-/m0/s1
InChI key： IHTMWCSSFCOBDV-UHTQNRGBSA-N
SMILES： O[C@H]([C@H]1C[C@@H]2CC[N@@+]1(Cc1c3ccccc3cc3ccccc13)C[C@@H]2C=C)c1ccnc2ccccc12
Systematic name  (11)：
  • (αS,1S,2R,4S,5R)-α-(4-キノリニル)-1-(9-アントリルメチル)-5-ビニルキヌクリジニウム-2β-メタノール
  • (9S)-1-(9-アントラセニルメチル)-9-ヒドロキシシンコナン-1-イウム
  • (9S)-1-(9-アントリルメチル)-9-ヒドロキシシンコナン-1-イウム
  • (9S)-1-[(9-アントリル)メチル]-1-アゾニアシンコナン-9-オール
  • (9S)-1-[(9-アントリル)メチル]-9-ヒドロキシシンコナン-1-イウム
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Other name (9)：
  • (αS,1S,2R,4S,5R)-α-(4-Quinolinyl)-1-(9-anthrylmethyl)-5-vinylquinuclidinium-2β-methanol
  • (9S)-1-(9-Anthracenylmethyl)-9-hydroxycinchonan-1-ium
  • (9S)-1-(9-Anthrylmethyl)-9-hydroxycinchonan-1-ium
  • (9S)-1-[(9-Anthryl)methyl]-1-azoniacinchonan-9-ol
  • (9S)-1-[(9-Anthryl)methyl]-9-hydroxycinchonan-1-ium
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