Chem
J-GLOBAL ID：200907082375600460   Nikkaji number：J15.452K

Ankorine

アンコリン
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： C19H29NO4
Molecular formula furigana： C19-H29-N-O4
Molecular weight： 335.444
InChI： InChI=1S/C19H29NO4/c1-4-12-11-20-7-5-14-15(16(20)9-13(12)6-8-21)10-17(23-2)19(24-3)18(14)22/h10,12-13,16,21-22H,4-9,11H2,1-3H3/t12-,13-,16-/m0/s1
InChI key： UYQRWUWLBSTWCM-XEZPLFJOSA-N
SMILES： CC[C@H]1CN2CCc3c(O)c(OC)c(OC)cc3[C@@H]2C[C@@H]1CCO
Systematic name  (3)：
  • [2R,(-)]-3β-エチル-1,3,4,6,7,11bβ-ヘキサヒドロ-8-ヒドロキシ-9,10-ジメトキシ-2H-ベンゾ[a]キノリジン-2-エタノール
  • (2R,3R,11bS)-3-エチル-2-(2-ヒドロキシエチル)-9,10-ジメトキシ-1H,2H,3H,4H,6H,7H,11bH-ピリド[2,1-a]イソキノリン-8-オール
  • (2R,3R,11bS)-3-ethyl-2-(2-hydroxyethyl)-9,10-dimethoxy-1H,2H,3H,4H,6H,7H,11bH-pyrido[2,1-a]isoquinolin-8-ol
Other name (5)：
  • アンコリン
  • (-)-アンコリン
  • Ankorine
  • (-)-Ankorine
  • [2R,(-)]-3β-Ethyl-1,3,4,6,7,11bβ-hexahydro-8-hydroxy-9,10-dimethoxy-2H-benzo[a]quinolizine-2-ethanol
CAS registry number： 13849-54-2
KEGG COMPOUND： C09337
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