Chem
J-GLOBAL ID：200907091092145862   Nikkaji number：J759.535B

9,10-Dimethoxy-7β-methyl-5,6,7,8,13,13aα-hexahydrobenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium

9,10-ジメトキシ-7β-メチル-5,6,7,8,13,13aα-ヘキサヒドロベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
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： C21H24[N+]O4
Molecular formula furigana： C21-H24-N-O4
Molecular weight： 354.425
InChI： InChI=1S/C21H24NO4/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22/h4-5,9-10,17H,6-8,11-12H2,1-3H3/q+1/t17-,22+/m0/s1
InChI key： IPABSWBNWMXCHM-HTAPYJJXSA-N
SMILES： COc1ccc2C[C@H]3c4cc5OCOc5cc4CC[N@+]3(C)Cc2c1OC
Systematic name  (4)：
  • 9,10-ジメトキシ-7β-メチル-5,6,7,8,13,13aα-ヘキサヒドロベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
  • (7R,13aS)-7β-メチル-5,8,13,13a-テトラヒドロ-9,10-ジメトキシ-6H-ベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
  • (1S,13R)-16,17-ジメトキシ-13-メチル-5,7-ジオキサ-13-アザペンタシクロ[11.8.0.02,10.04,8.015,20]ヘンイコサ-2,4(8),9,15,17,19-ヘキサエン-13-イウム
  • (1S,13R)-16,17-dimethoxy-13-methyl-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15,17,19-hexaen-13-ium
Other name (2)：
  • 9,10-Dimethoxy-7β-methyl-5,6,7,8,13,13aα-hexahydrobenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
  • (7R,13aS)-7β-Methyl-5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
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