Chem
J-GLOBAL ID：200907094589165173   Nikkaji number：J2.309.100C

2-(2-Hydroxybenzyl)-4,4-bis(benzyloxymethyl)-2-azabicyclo[3.3.1]nonane-8α-ol

2-(2-ヒドロキシベンジル)-4,4-ビス(ベンジルオキシメチル)-2-アザビシクロ[3.3.1]ノナン-8α-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： C31H37NO4
Molecular formula furigana： C31-H37-N-O4
Molecular weight： 487.640
InChI： InChI=1S/C31H37NO4/c33-29-14-8-7-13-26(29)18-32-21-31(27-15-16-30(34)28(32)17-27,22-35-19-24-9-3-1-4-10-24)23-36-20-25-11-5-2-6-12-25/h1-14,27-28,30,33-34H,15-23H2/t27?,28?,30-/m0/s1
InChI key： NQVVKVHBOZYSRP-UEYYRQBOSA-N
SMILES： O[C@H]1CCC2CC1N(Cc1ccccc1O)CC2(COCc1ccccc1)COCc1ccccc1
Systematic name  (3)：
  • 2-(2-ヒドロキシベンジル)-4,4-ビス(ベンジルオキシメチル)-2-アザビシクロ[3.3.1]ノナン-8α-オール
  • (8S)-4,4-ビス[(ベンジルオキシ)メチル]-2-[(2-ヒドロキシフェニル)メチル]-2-アザビシクロ[3.3.1]ノナン-8-オール
  • (8S)-4,4-bis[(benzyloxy)methyl]-2-[(2-hydroxyphenyl)methyl]-2-azabicyclo[3.3.1]nonan-8-ol
Other name (1)：
  • 2-(2-Hydroxybenzyl)-4,4-bis(benzyloxymethyl)-2-azabicyclo[3.3.1]nonane-8α-ol
Thsaurus map：
Thesaurus Map

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