Chem
J-GLOBAL ID:200907049947402624   Nikkaji number:J2.091.444K

(3R,7aS,11aR)-5β-Hexyl-7α-(dihydroxyboryl)-2,3,5,6,7,7a,8,9,10,11-decahydro-1H-pyrrolo[2,1-j]quinoline-3α-methanol

[(3R,5S,7S,7aS,11aR)-5-ヘキシル-3-(ヒドロキシメチル)-デカヒドロ-1H-ピロロ[2,1-f307696]キノリン-7-イル]ボロン酸
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: C19H36BNO3
Molecular formula furigana: C19-H36-B-N-O3
Molecular weight: 337.310
InChI: InChI=1S/C19H36BNO3/c1-2-3-4-5-8-15-13-18(20(23)24)17-9-6-7-11-19(17)12-10-16(14-22)21(15)19/h15-18,22-24H,2-14H2,1H3/t15-,16+,17-,18-,19+/m0/s1
InChI key: RNMFXUMOOWBXNK-XCDZQEORSA-N
SMILES: CCCCCC[C@H]1C[C@H](B(O)O)[C@@H]2CCCC[C@]32CC[C@H](CO)N13
Systematic name  (3):
  • (3R,7aS,11aR)-5β-ヘキシル-7α-(ジヒドロキシボリル)-2,3,5,6,7,7a,8,9,10,11-デカヒドロ-1H-ピロロ[2,1-j]キノリン-3α-メタノール
  • [(3R,5S,7S,7aS,11aR)-5-ヘキシル-3-(ヒドロキシメチル)-デカヒドロ-1H-ピロロ[2,1-f307696]キノリン-7-イル]ボロン酸
  • [(3R,5S,7S,7aS,11aR)-5-hexyl-3-(hydroxymethyl)-decahydro-1H-pyrrolo[2,1-f307696]quinolin-7-yl]boronic acid
Other name (1):
  • (3R,7aS,11aR)-5β-Hexyl-7α-(dihydroxyboryl)-2,3,5,6,7,7a,8,9,10,11-decahydro-1H-pyrrolo[2,1-j]quinoline-3α-methanol
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