Chem
J-GLOBAL ID：200907001174992092   Nikkaji number：J1.849.923A

Balfourodinium

バルフロジニウム
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： C17H22[N+]O4
Molecular formula furigana： C17-H22-N-O4
Molecular weight： 304.365
InChI： InChI=1S/C17H22NO4/c1-17(2,19)13-9-11-15(21-5)10-7-6-8-12(20-4)14(10)18(3)16(11)22-13/h6-8,13,19H,9H2,1-5H3/q+1/t13-/m1/s1
InChI key： OQZCPLGYHZLFBM-CYBMUJFWSA-N
SMILES： COc1cccc2c(OC)c3C[C@@H](Oc3[n+](C)c12)C(C)(C)O
Systematic name  (4)：
  • (2R)-α,α,9-トリメチル-2,3-ジヒドロ-4,8-ジメトキシフロ[2,3-b]キノリニウム-2-メタノール
  • (R)-2,3-ジヒドロ-2-(1-ヒドロキシ-1-メチルエチル)-4,8-ジメトキシ-9-メチルフロ[2,3-b]キノリニウム
  • (2R)-2-(2-ヒドロキシプロパン-2-イル)-4,8-ジメトキシ-9-メチル-2H,3H-フロ[2,3-b]キノリン-9-イウム
  • (2R)-2-(2-hydroxypropan-2-yl)-4,8-dimethoxy-9-methyl-2H,3H-furo[2,3-b]quinolin-9-ium
Other name (6)：
  • (2R)-α,α,9-Trimethyl-2,3-dihydro-4,8-dimethoxyfuro[2,3-b]quinolinium-2-methanol
  • (R)-2,3-Dihydro-2-(1-hydroxy-1-methylethyl)-4,8-dimethoxy-9-methylfuro[2,3-b]quinolinium
  • Balfourodinium
  • 4-Methoxybalfourodinium
  • バルフロジニウム
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CAS registry number： 38487-24-0
KEGG COMPOUND： C10648
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