Chem
J-GLOBAL ID：200907012116205139   Nikkaji number：J1.761.693E

(2S)-α,α-Dimethyl-1-(methoxycarbonyl)-5-[[(3aα,6aα)-6β-hydroxy-6-methyloctahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,2-dihydropyridine-2α-acetic acid methyl ester

(2S)-α,α-ジメチル-1-(メトキシカルボニル)-5-[[(3aα,6aα)-6β-ヒドロキシ-6-メチルオクタヒドロシクロペンタ[b]ピロール-1-イル]カルボニル]-1,2-ジヒドロピリジン-2α-酢酸メチル
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： C21H30N2O6
Molecular formula furigana： C21-H30-N2-O6
Molecular weight： 406.479
InChI： InChI=1S/C21H30N2O6/c1-20(2,18(25)28-4)15-7-6-14(12-23(15)19(26)29-5)17(24)22-11-9-13-8-10-21(3,27)16(13)22/h6-7,12-13,15-16,27H,8-11H2,1-5H3/t13-,15+,16+,21-/m1/s1
InChI key： YEIQRSMFSQYESJ-CDSQMECRSA-N
SMILES： COC(=O)N1C=C(C=C[C@H]1C(C)(C)C(=O)OC)C(=O)N1CC[C@H]2CC[C@@](C)(O)[C@@H]12
Systematic name  (3)：
  • (2S)-α,α-ジメチル-1-(メトキシカルボニル)-5-[[(3aα,6aα)-6β-ヒドロキシ-6-メチルオクタヒドロシクロペンタ[b]ピロール-1-イル]カルボニル]-1,2-ジヒドロピリジン-2α-酢酸メチル
  • メチル (2S)-5-[(3aR,6R,6aS)-6-ヒドロキシ-6-メチル-オクタヒドロシクロペンタ[b]ピロール-1-カルボニル]-2-(1-メトキシ-2-メチル-1-オキソプロパン-2-イル)-1,2-ジヒドロピリジン-1-カルボキシラート
  • methyl (2S)-5-[(3aR,6R,6aS)-6-hydroxy-6-methyl-octahydrocyclopenta[b]pyrrole-1-carbonyl]-2-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1,2-dihydropyridine-1-carboxylate
Other name (1)：
  • (2S)-α,α-Dimethyl-1-(methoxycarbonyl)-5-[[(3aα,6aα)-6β-hydroxy-6-methyloctahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,2-dihydropyridine-2α-acetic acid methyl ester
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