Chem
J-GLOBAL ID：200907056464702313   Nikkaji number：J38.518B

Alangimarckine

アランギマルキン
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： C29H37N3O3
Molecular formula furigana： C29-H37-N3-O3
Molecular weight： 475.633
InChI： InChI=1S/C29H37N3O3/c1-4-17-16-32-12-10-21-22(15-26(34-2)29(35-3)28(21)33)25(32)14-18(17)13-24-27-20(9-11-30-24)19-7-5-6-8-23(19)31-27/h5-8,15,17-18,24-25,30-31,33H,4,9-14,16H2,1-3H3/t17-,18-,24+,25-/m0/s1
InChI key： BZIKDLPHKDIUHH-PCYHDRSOSA-N
SMILES： CC[C@H]1CN2CCc3c(O)c(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2c1[nH]c1ccccc21
Systematic name  (3)：
  • 10,11-ジメトキシツブロサン-9-オール
  • (2S,3R,11bS)-3-エチル-9,10-ジメトキシ-2-{[(1R)-1H,2H,3H,4H,9H-ピリド[3,4-b]インドール-1-イル]メチル}-1H,2H,3H,4H,6H,7H,11bH-ピリド[2,1-a]イソキノリン-8-オール
  • (2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2-{[(1R)-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl]methyl}-1H,2H,3H,4H,6H,7H,11bH-pyrido[2,1-a]isoquinolin-8-ol
Other name (4)：
  • アランギマルキン
  • アランギマルッキン
  • Alangimarckine
  • 10,11-Dimethoxytubulosan-9-ol
CAS registry number： 13849-53-1
KEGG COMPOUND： C09328
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