Chem
J-GLOBAL ID：200907088165528187   Nikkaji number：J1.767.334C

(S)-cis-N-methylstylopine

(S)-cis-N-メチルスチロピン
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： C20H20[N+]O4
Molecular formula furigana： C20-H20-N-O4
Molecular weight： 338.382
InChI： InChI=1S/C20H20NO4/c1-21-5-4-13-7-18-19(24-10-23-18)8-14(13)16(21)6-12-2-3-17-20(15(12)9-21)25-11-22-17/h2-3,7-8,16H,4-6,9-11H2,1H3/q+1/t16-,21-/m0/s1
InChI key： GBUUKFRQPCPYPW-KKSFZXQISA-N
SMILES： C[N@@+]12CCc3cc4OCOc4cc3[C@@H]1Cc1ccc3OCOc3c1C2
Systematic name  (4)：
  • (5S,12bS)-5-メチル-6,7,12bβ,13-テトラヒドロ-4H-ビス[1,3]ベンゾジオキソロ[5,6-a:4′,5′-g]キノリジン-5-イウム
  • (5S,12bS)-6,7,12b,13-テトラヒドロ-5-メチル-4H-ビス[1,3]ベンゾジオキソロ[5,6-a:4′,5′-g]キノリジン-5-イウム
  • (1S,13S)-13-メチル-5,7,17,19-テトラオキサ-13-アザヘキサシクロ[11.11.0.02,10.04,8.015,23.016,20]テトラコサ-2,4(8),9,15,20,22-ヘキサエン-13-イウム
  • (1S,13S)-13-methyl-5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15,20,22-hexaen-13-ium
Other name (4)：
  • (5S,12bS)-5-Methyl-6,7,12bβ,13-tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4′,5′-g]quinolizine-5-ium
  • (5S,12bS)-6,7,12b,13-Tetrahydro-5-methyl-4H-bis[1,3]benzodioxolo[5,6-a:4′,5′-g]quinolizine-5-ium
  • (S)-cis-N-methylstylopine
  • (S)-cis-N-メチルスチロピン
KEGG COMPOUND： C06163
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