Chem
J-GLOBAL ID：200907083017681250   Nikkaji number：J1.671.010E

(S)-O-Methylkreysigine

(S)-O-メチルクレイシギン
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： C23H29NO5
Molecular formula furigana： C23-H29-N-O5
Molecular weight： 399.487
InChI： InChI=1S/C23H29NO5/c1-24-10-9-14-12-16(25-2)21(27-4)20-18(14)15(24)8-7-13-11-17(26-3)22(28-5)23(29-6)19(13)20/h11-12,15H,7-10H2,1-6H3/t15-/m0/s1
InChI key： VIZHHLWKNPFRJY-HNNXBMFYSA-N
SMILES： COc1cc2CCN(C)[C@H]3CCc4cc(OC)c(OC)c(OC)c4c(c1OC)c23
Systematic name  (4)：
  • (6aS)-4,5,6,6aα,7,8-ヘキサヒドロ-1,2,10,11,12-ペンタメトキシ-6-メチルベンゾ[6,7]シクロヘプタ[1,2,3-ij]イソキノリン
  • (6aS)-1,2,10,11,12-ペンタメトキシ-6-メチル-4,5,6,6aα,7,8-ヘキサヒドロベンゾ[6,7]シクロヘプタ[1,2,3-ij]イソキノリン
  • (10S)-3,4,5,16,17-ペンタメトキシ-11-メチル-11-アザテトラシクロ[8.7.1.02,7.014,18]オクタデカ-1(17),2,4,6,14(18),15-ヘキサエン
  • (10S)-3,4,5,16,17-pentamethoxy-11-methyl-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),2,4,6,14(18),15-hexaene
Other name (4)：
  • (6aS)-4,5,6,6aα,7,8-Hexahydro-1,2,10,11,12-pentamethoxy-6-methylbenzo[6,7]cyclohepta[1,2,3-ij]isoquinoline
  • (S)-O-メチルクレイシギン
  • (S)-O-Methylkreysigine
  • (6aS)-1,2,10,11,12-Pentamethoxy-6-methyl-4,5,6,6aα,7,8-hexahydrobenzo[6,7]cyclohepta[1,2,3-ij]isoquinoline
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