Chem
J-GLOBAL ID：200907089369531671   Nikkaji number：J15.138F

Dioscorine

ジオスコリン
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： C13H19NO2
Molecular formula furigana： C13-H19-N-O2
Molecular weight： 221.300
InChI： InChI=1S/C13H19NO2/c1-9-5-12(15)16-13(6-9)7-11-4-3-10(13)8-14(11)2/h5,10-11H,3-4,6-8H2,1-2H3/t10-,11-,13-/m1/s1
InChI key： YBQKKTNDAXVYGX-NQBHXWOUSA-N
SMILES： CN1C[C@H]2CC[C@@H]1C[C@@]12CC(=CC(=O)O1)C
Systematic name  (3)：
  • (1R,4R,5R)-2,4′-ジメチルスピロ[2-アザビシクロ[2.2.2]オクタン-5,2′-[2H]ピラン]-6′(3′H)-オン
  • (1R,2R,4R)-4',5-ジメチル-3',6'-ジヒドロ-5-アザスピロ[ビシクロ[2.2.2]オクタン-2,2'-ピラン]-6'-オン
  • (1R,2R,4R)-4',5-dimethyl-3',6'-dihydro-5-azaspiro[bicyclo[2.2.2]octane-2,2'-pyran]-6'-one
Other name (3)：
  • ジオスコリン
  • Dioscorine
  • (1R,4R,5R)-2,4′-Dimethylspiro[2-azabicyclo[2.2.2]octane-5,2′-[2H]pyran]-6′(3′H)-one
CAS registry number： 3329-91-7
Regulation number (1)：
  • JG5787500
KEGG COMPOUND： C10142
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM