Chem
J-GLOBAL ID：201407049837453150   Nikkaji number：J3.258.841G

(±)-Pumiliotoxin 251D

(±)-プミリオトキシン251D
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： C16H29NO
Molecular formula furigana： C16-H29-N-O
Molecular weight： 251.414
InChI： InChI=1S/C16H29NO/c1-4-5-7-13(2)10-14-11-16(3,18)15-8-6-9-17(15)12-14/h10,13,15,18H,4-9,11-12H2,1-3H3/t13-,15+,16+/m1/s1
InChI key： OKTQTXDNHCOLHT-KBMXLJTQSA-N
SMILES： CCCC[C@@H](C)C=C1CN2CCC[C@H]2[C@@](C)(O)C1
Systematic name  (3)：
  • (8aS)-6-((2R)-2-メチルヘキシリデン)-8β-メチル-1,2,3,5,6,7,8,8aβ-オクタヒドロインドリジン-8α-オール
  • (8S,8aS)-8-メチル-6-[(2R)-2-メチルヘキシリデン]-オクタヒドロインドリジン-8-オール
  • (8S,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-octahydroindolizin-8-ol
Other name (3)：
  • (8aS)-6-((2R)-2-Methylhexylidene)-8β-methyl-1,2,3,5,6,7,8,8aβ-octahydroindolizine-8α-ol
  • (±)-プミリオトキシン251D
  • (±)-Pumiliotoxin 251D
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