Chem
J-GLOBAL ID:200907068568046530
Nikkaji number:J2.077.876H
(1α,5α)-4-(Benzyloxymethyl)-6β-(aminomethyl)-2-azabicyclo[3.3.1]nonane-4β-methanol
(1α,5α)-4-(ベンジルオキシメチル)-6β-(アミノメチル)-2-アザビシクロ[3.3.1]ノナン-4β-メタノール
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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:
C18 H28 N2 O2
Molecular formula furigana:
C18-H28-N2-O2
Molecular weight:
304.434
InChI:
InChI=1S/C18H28N2O2/c19-9-15-6-7-16-8-17(15)18(12-21,11-20-16)13-22-10-14-4-2-1-3-5-14/h1-5,15-17,20-21H,6-13,19H2/t15-,16-,17-,18+/m1/s1
InChI key:
QNWUBGHVNBENFL-TVFCKZIOSA-N
SMILES:
NC[C@H]1CC[C@@H]2C[C@H]1[C@@](CO)(COCc1ccccc1)CN2
Systematic name (3):
(1α,5α)-4-(ベンジルオキシメチル)-6β-(アミノメチル)-2-アザビシクロ[3.3.1]ノナン-4β-メタノール
[(1R,4R,5R,6S)-6-(アミノメチル)-4-[(ベンジルオキシ)メチル]-2-アザビシクロ[3.3.1]ノナン-4-イル]メタノール
[(1R,4R,5R,6S)-6-(aminomethyl)-4-[(benzyloxy)methyl]-2-azabicyclo[3.3.1]nonan-4-yl]methanol
Other name (1):
(1α,5α)-4-(Benzyloxymethyl)-6β-(aminomethyl)-2-azabicyclo[3.3.1]nonane-4β-methanol
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