Chem
J-GLOBAL ID：200907049746630297   Nikkaji number：J1.075.244B

16-Fuluoroaphidicolin

16-フルオロアフィジコリン
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： C20H33FO3
Molecular formula furigana： C20-H33-F-O3
Molecular weight： 340.479
InChI： InChI=1S/C20H33FO3/c1-17(11-22)15-4-3-13-9-14-10-19(13,7-8-20(14,21)12-23)18(15,2)6-5-16(17)24/h13-16,22-24H,3-12H2,1-2H3/t13-,14+,15-,16+,17-,18-,19-,20-/m0/s1
InChI key： QZBHREIKGLXHFS-APNQCZIXSA-N
SMILES： C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]1C[C@@H]3C[C@]21CC[C@]3(F)CO
Systematic name  (3)：
  • (3R,4aβ,6aα)-テトラデカヒドロ-3β-ヒドロキシ-4,11bα-ジメチル-8α,11aα-メタノ-9α-フルオロ-11aH-シクロヘプタ[a]ナフタレン-4β,9β-ジメタノール
  • (1S,2S,5R,6R,7R,10S,12R,13R)-13-フルオロ-6,13-ビス(ヒドロキシメチル)-2,6-ジメチルテトラシクロ[10.3.1.01,10.02,7]ヘキサデカン-5-オール
  • (1S,2S,5R,6R,7R,10S,12R,13R)-13-fluoro-6,13-bis(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.01,10.02,7]hexadecan-5-ol
Other name (3)：
  • (3R,4aβ,6aα)-Tetradecahydro-3β-hydroxy-4,11bα-dimethyl-8α,11aα-methano-9α-fluoro-11aH-cyclohepta[a]naphthalene-4β,9β-dimethanol
  • 16-フルオロアフィジコリン
  • 16-Fuluoroaphidicolin
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