Chem
J-GLOBAL ID：201607019351149670   Nikkaji number：J3.488.877I

Tolypyridone B

トリピリドンB
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： C15H21NO2
Molecular formula furigana： C15-H21-N-O2
Molecular weight： 247.338
InChI： InChI=1S/C15H21NO2/c1-4-11-8-9(2)7-10(3)13(11)14-12(17)5-6-16-15(14)18/h4-6,9-11,13H,1,7-8H2,2-3H3,(H2,16,17,18)/t9-,10+,11-,13-/m1/s1
InChI key： SWIJWROLKBJDFO-LSCVPOLPSA-N
SMILES： C[C@@H]1C[C@H](C)[C@H]([C@@H](C1)C=C)c1c(O)cc[nH]c1=O
Systematic name  (3)：
  • 3-(4α,6α-ジメチル-2α-エテニルシクロヘキサン-1β-イル)-4-ヒドロキシピリジン-2(1H)-オン
  • 3-[(1R,2S,4R,6S)-2-エテニル-4,6-ジメチルシクロヘキシル]-4-ヒドロキシ-1,2-ジヒドロピリジン-2-オン
  • 3-[(1R,2S,4R,6S)-2-ethenyl-4,6-dimethylcyclohexyl]-4-hydroxy-1,2-dihydropyridin-2-one
Other name (3)：
  • 3-(4α,6α-Dimethyl-2α-ethenylcyclohexane-1β-yl)-4-hydroxypyridine-2(1H)-one
  • トリピリドンB
  • Tolypyridone B
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