Chem
J-GLOBAL ID：200907081521470372   Nikkaji number：J623.881E

(-)-Ondansetron

(-)-オンダンセトロン
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： C18H19N3O
Molecular formula furigana： C18-H19-N3-O
Molecular weight： 293.370
InChI： InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3/t13-/m1/s1
InChI key： FELGMEQIXOGIFQ-CYBMUJFWSA-N
SMILES： Cc1nccn1C[C@H]1CCc2c(C1=O)c1ccccc1n2C
Systematic name  (4)：
  • (3R)-1,2,3,9-テトラヒドロ-9-メチル-3-[(2-メチル-1H-イミダゾール-1-イル)メチル]-4H-カルバゾール-4-オン
  • 1,2,3,9-テトラヒドロ-9-メチル-3α-[(2-メチル-1H-イミダゾール-1-イル)メチル]-4H-カルバゾール-4-オン
  • (3R)-9-メチル-3-[(2-メチル-1H-イミダゾール-1-イル)メチル]-2,3,4,9-テトラヒドロ-1H-カルバゾール-4-オン
  • (3R)-9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazol-4-one
Other name (3)：
  • 1,2,3,9-Tetrahydro-9-methyl-3α-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one
  • (-)-オンダンセトロン
  • (-)-Ondansetron
CAS registry number： 99614-60-5
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