Chem
J-GLOBAL ID:200907045979004862   Nikkaji number:J624.940J

SQ-12151

(2R,3S,2′S)-ナドロール
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: C17H27NO4
Molecular formula furigana: C17-H27-N-O4
Molecular weight: 309.406
InChI: InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12-,14+,15-/m0/s1
InChI key: VWPOSFSPZNDTMJ-CFVMTHIKSA-N
SMILES: CC(C)(C)NC[C@H](O)COc1cccc2C[C@@H](O)[C@@H](O)Cc12
Systematic name  (5):
  • 5-[(S)-3-[(1,1-ジメチルエチル)アミノ]-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロナフタレン-2β,3β-ジオール
  • (2R,3S)-5-[(2S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロ-2,3-ナフタレンジオール
  • (2R,3S)-5-[(S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロ-2,3-ナフタレンジオール
  • (2R,3S)-5-[(2S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロナフタレン-2,3-ジオール
  • (2R,3S)-5-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol
Other name (6):
  • (2R,3S,2′S)-ナドロール
  • (2R,3S,2′S)-Nadolol
  • SQ-12151
  • (2R,3S)-5-[(2S)-3-(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol
  • 5-[(S)-3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2β,3β-diol
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CAS registry number: 54933-36-7
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