Chem
J-GLOBAL ID：201407021209690168   Nikkaji number：J3.310.847H

3β,4β-(Isopropylidenebisoxy)-5aα-(2-oxo-2-methoxyethyl)-8-oxo-2,3,4,4aβ,5a,6,7,8,8aα,8bβ-decahydro-1H-pyrrolo[3′,4′:4,5]furo[3,2-b]pyridine-1,6α-dicarboxylic acid 1-tert-butyl 6-methyl ester

3β,4β-(イソプロピリデンビスオキシ)-5aα-(2-オキソ-2-メトキシエチル)-8-オキソ-2,3,4,4aβ,5a,6,7,8,8aα,8bβ-デカヒドロ-1H-ピロロ[3′,4′:4,5]フロ[3,2-b]ピリジン-1,6α-ジカルボン酸1-tert-ブチル6-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： C22H32N2O10
Molecular formula furigana： C22-H32-N2-O10
Molecular weight： 484.502
InChI： InChI=1S/C22H32N2O10/c1-20(2,3)34-19(28)24-9-10-14(32-21(4,5)31-10)15-13(24)12-17(26)23-16(18(27)30-7)22(12,33-15)8-11(25)29-6/h10,12-16H,8-9H2,1-7H3,(H,23,26)/t10-,12-,13+,14-,15-,16+,22-/m1/s1
InChI key： KROQJYJRVKZUEN-YYAFNTQHSA-N
SMILES： COC(=O)C[C@@]12O[C@H]3[C@@H]4OC(C)(C)O[C@@H]4CN([C@H]3[C@@H]1C(=O)N[C@H]2C(=O)OC)C(=O)OC(C)(C)C
Systematic name  (3)：
  • 3β,4β-(イソプロピリデンビスオキシ)-5aα-(2-オキソ-2-メトキシエチル)-8-オキソ-2,3,4,4aβ,5a,6,7,8,8aα,8bβ-デカヒドロ-1H-ピロロ[3′,4′:4,5]フロ[3,2-b]ピリジン-1,6α-ジカルボン酸1-tert-ブチル6-メチル
  • 8-tert-ブチル 13-メチル (1R,2R,6R,9S,10S,13R,14R)-14-(2-メトキシ-2-オキソエチル)-4,4-ジメチル-11-オキソ-3,5,15-トリオキサ-8,12-ジアザテトラシクロ[7.6.0.02,6.010,14]ペンタデカン-8,13-ジカルボキシラート
  • 8-tert-butyl 13-methyl (1R,2R,6R,9S,10S,13R,14R)-14-(2-methoxy-2-oxoethyl)-4,4-dimethyl-11-oxo-3,5,15-trioxa-8,12-diazatetracyclo[7.6.0.02,6.010,14]pentadecane-8,13-dicarboxylate
Other name (1)：
  • 3β,4β-(Isopropylidenebisoxy)-5aα-(2-oxo-2-methoxyethyl)-8-oxo-2,3,4,4aβ,5a,6,7,8,8aα,8bβ-decahydro-1H-pyrrolo[3′,4′:4,5]furo[3,2-b]pyridine-1,6α-dicarboxylic acid 1-tert-butyl 6-methyl ester
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