Chem
J-GLOBAL ID:200907044898749654   Nikkaji number:J2.077.874A

(1α,5α)-2-(tert-Butoxycarbonyl)-4α-(benzyloxymethyl)-4-(methoxymethoxymethyl)-2-azabicyclo[3.3.1]nonane-6β-methanol

(1α,5α)-2-(tert-ブトキシカルボニル)-4α-(ベンジルオキシメチル)-4-(メトキシメトキシメチル)-2-アザビシクロ[3.3.1]ノナン-6β-メタノール
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: C25H39NO6
Molecular formula furigana: C25-H39-N-O6
Molecular weight: 449.588
InChI: InChI=1S/C25H39NO6/c1-24(2,3)32-23(28)26-15-25(17-31-18-29-4,16-30-14-19-8-6-5-7-9-19)22-12-21(26)11-10-20(22)13-27/h5-9,20-22,27H,10-18H2,1-4H3/t20-,21-,22-,25-/m1/s1
InChI key: QJUXDHJTBKFSJS-NMOFPLQQSA-N
SMILES: COCOC[C@]1(COCc2ccccc2)CN([C@@H]2CC[C@H](CO)[C@H]1C2)C(=O)OC(C)(C)C
Systematic name  (3):
  • (1α,5α)-2-(tert-ブトキシカルボニル)-4α-(ベンジルオキシメチル)-4-(メトキシメトキシメチル)-2-アザビシクロ[3.3.1]ノナン-6β-メタノール
  • tert-ブチル (1R,4S,5R,6S)-4-[(ベンジルオキシ)メチル]-6-(ヒドロキシメチル)-4-[(メトキシメトキシ)メチル]-2-アザビシクロ[3.3.1]ノナン-2-カルボキシラート
  • tert-butyl (1R,4S,5R,6S)-4-[(benzyloxy)methyl]-6-(hydroxymethyl)-4-[(methoxymethoxy)methyl]-2-azabicyclo[3.3.1]nonane-2-carboxylate
Other name (1):
  • (1α,5α)-2-(tert-Butoxycarbonyl)-4α-(benzyloxymethyl)-4-(methoxymethoxymethyl)-2-azabicyclo[3.3.1]nonane-6β-methanol
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