Chem
J-GLOBAL ID:200907098189356170
Nikkaji number:J15.896H Littorine リットリン
Download MOL file 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: C17 H23 NO3 Molecular formula furigana:
C17-H23-N-O3
Molecular weight:
289.375
InChI:
InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)11-15(10-13)21-17(20)16(19)9-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16-/m1/s1
InChI key:
FNRXUEYLFZLOEZ-VFSICIBPSA-N
SMILES:
CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)[C@H](O)Cc1ccccc1
Systematic name (3): (R)-α-ヒドロキシベンゼンプロピオン酸(1R,5S)-8-メチル-8-アザビシクロ[3.2.1]オクタン-3α-イル (1R,5S)-8-メチル-8-アザビシクロ[3.2.1]オクタン-3-イル (2R)-2-ヒドロキシ-3-フェニルプロパノアート (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl (2R)-2-hydroxy-3-phenylpropanoate Other name (4): リットリン Littorine (R)-α-Hydroxybenzenepropionic acid (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3α-yl ester (R)-リットリン CAS registry number:
21956-47-8
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