Chem
J-GLOBAL ID：200907002341444880   Nikkaji number：J2.704.154J

(1R,2α,6α)-1α-Chloro-4α-tert-butyl-7α-hydroxy-3,8-dioxa-5-azatricyclo[5.3.0.02,6]decane-5-carboxylic acid methyl ester

(1R,2α,6α)-1α-クロロ-4α-tert-ブチル-7α-ヒドロキシ-3,8-ジオキサ-5-アザトリシクロ[5.3.0.02,6]デカン-5-カルボン酸メチル
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： C13H20ClNO5
Molecular formula furigana： C13-H20-CL-N-O5
Molecular weight： 305.760
InChI： InChI=1S/C13H20ClNO5/c1-11(2,3)9-15(10(16)18-4)7-8(20-9)12(14)5-6-19-13(7,12)17/h7-9,17H,5-6H2,1-4H3/t7-,8+,9-,12-,13-/m1/s1
InChI key： RHKWTHGKEJTPGZ-AVYYWPKPSA-N
SMILES： COC(=O)N1[C@@H]2[C@H](O[C@@H]1C(C)(C)C)[C@]1(Cl)CCO[C@]21O
Systematic name  (3)：
  • (1R,2α,6α)-1α-クロロ-4α-tert-ブチル-7α-ヒドロキシ-3,8-ジオキサ-5-アザトリシクロ[5.3.0.02,6]デカン-5-カルボン酸メチル
  • メチル (1R,2S,4R,6R,7R)-4-tert-ブチル-1-クロロ-7-ヒドロキシ-3,8-ジオキサ-5-アザトリシクロ[5.3.0.02,6]デカン-5-カルボキシラート
  • methyl (1R,2S,4R,6R,7R)-4-tert-butyl-1-chloro-7-hydroxy-3,8-dioxa-5-azatricyclo[5.3.0.02,6]decane-5-carboxylate
Other name (1)：
  • (1R,2α,6α)-1α-Chloro-4α-tert-butyl-7α-hydroxy-3,8-dioxa-5-azatricyclo[5.3.0.02,6]decane-5-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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