Chem
J-GLOBAL ID：200907097000166867   Nikkaji number：J2.077.481I

(1S)-2-(tert-Butoxycarbonyl)-3α-(5-oxazolyl)-1,2,3,4-tetrahydro-β-carboline-1α-acetaldehyde

(1S)-2-(tert-ブトキシカルボニル)-3α-(5-オキサゾリル)-1,2,3,4-テトラヒドロ-β-カルボリン-1α-アセトアルデヒド
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： C21H23N3O4
Molecular formula furigana： C21-H23-N3-O4
Molecular weight： 381.432
InChI： InChI=1S/C21H23N3O4/c1-21(2,3)28-20(26)24-16(8-9-25)19-14(10-17(24)18-11-22-12-27-18)13-6-4-5-7-15(13)23-19/h4-7,9,11-12,16-17,23H,8,10H2,1-3H3/t16-,17-/m0/s1
InChI key： CSODGYXMTUCRTR-IRXDYDNUSA-N
SMILES： CC(C)(C)OC(=O)N1[C@@H](CC=O)c2[nH]c3ccccc3c2C[C@H]1c1cnco1
Systematic name  (5)：
  • (1S)-2-(tert-ブトキシカルボニル)-3α-(5-オキサゾリル)-1,2,3,4-テトラヒドロ-β-カルボリン-1α-アセトアルデヒド
  • 1α-(2-オキソエチル)-3α-(5-オキサゾリル)-1,2,3,4-テトラヒドロ-9H-ピリド[3,4-b]インドール-2-カルボン酸tert-ブチル
  • (1S,3S)-2-(tert-ブチルオキシカルボニル)-3-(5-オキサゾリル)-1,2,3,4-テトラヒドロ-β-カルボリン-1-アセトアルデヒド
  • tert-ブチル (1S,3S)-3-(1,3-オキサゾール-5-イル)-1-(2-オキソエチル)-1H,2H,3H,4H,9H-ピリド[3,4-b]インドール-2-カルボキシラート
  • tert-butyl (1S,3S)-3-(1,3-oxazol-5-yl)-1-(2-oxoethyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-carboxylate
Other name (3)：
  • (1S)-2-(tert-Butoxycarbonyl)-3α-(5-oxazolyl)-1,2,3,4-tetrahydro-β-carboline-1α-acetaldehyde
  • 1α-(2-Oxoethyl)-3α-(5-oxazolyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester
  • (1S,3S)-2-(tert-Butyloxycarbonyl)-3-(5-oxazolyl)-1,2,3,4-tetrahydro-β-carboline-1-acetaldehyde
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