Chem
J-GLOBAL ID：200907094227134571   Nikkaji number：J848.734K

13-Hexylberberine

13-ヘキシルベルベリン
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： C26H30[N+]O4
Molecular formula furigana： C26-H30-N-O4
Molecular weight： 420.528
InChI： InChI=1S/C26H30NO4/c1-4-5-6-7-8-19-18-9-10-22(28-2)26(29-3)21(18)15-27-12-11-17-13-23-24(31-16-30-23)14-20(17)25(19)27/h9-10,13-15H,4-8,11-12,16H2,1-3H3/q+1
InChI key： ZVNQSARSOIPNFE-UHFFFAOYSA-N
SMILES： CCCCCCc1c2c3cc4OCOc4cc3CC[n+]2cc2c(OC)c(OC)ccc12
Systematic name  (3)：
  • 9,10-ジメトキシ-13-ヘキシル-5,6-ジヒドロベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
  • 21-ヘキシル-16,17-ジメトキシ-5,7-ジオキサ-13λ5-アザペンタシクロ[11.8.0.02,10.04,8.015,20]ヘンイコサ-1(13),2,4(8),9,14,16,18,20-オクタエン-13-イリウム
  • 21-hexyl-16,17-dimethoxy-5,7-dioxa-13λ5-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-13-ylium
Other name (3)：
  • 13-ヘキシルベルベリン
  • 13-Hexylberberine
  • 9,10-Dimethoxy-13-hexyl-5,6-dihydrobenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
Thsaurus map：
Thesaurus Map

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