Chem
J-GLOBAL ID：200907016939444231   Nikkaji number：J1.761.689G

(4S)-α,α-Dimethyl-1-(methoxycarbonyl)-3-[[(3aα,6aα)-6β-hydroxy-6-phenyloctahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,4-dihydropyridine-4β-acetic acid methyl ester

(4S)-α,α-ジメチル-1-(メトキシカルボニル)-3-[[(3aα,6aα)-6β-ヒドロキシ-6-フェニ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]-1,4-ジヒドロピリジン-4β-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： C26H32N2O6
Molecular formula furigana： C26-H32-N2-O6
Molecular weight： 468.550
InChI： InChI=1S/C26H32N2O6/c1-25(2,23(30)33-3)20-12-14-27(24(31)34-4)16-19(20)22(29)28-15-11-17-10-13-26(32,21(17)28)18-8-6-5-7-9-18/h5-9,12,14,16-17,20-21,32H,10-11,13,15H2,1-4H3/t17-,20+,21+,26+/m1/s1
InChI key： CRTNZOPQRHSLDD-IDPPLZKOSA-N
SMILES： COC(=O)N1C=C[C@@H](C(=C1)C(=O)N1CC[C@H]2CC[C@@](O)([C@@H]12)c1ccccc1)C(C)(C)C(=O)OC
Systematic name  (3)：
  • (4S)-α,α-ジメチル-1-(メトキシカルボニル)-3-[[(3aα,6aα)-6β-ヒドロキシ-6-フェニ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]-1,4-ジヒドロピリジン-4β-酢酸メチル
  • メチル (4S)-3-[(3aR,6S,6aS)-6-ヒドロキシ-6-フェニル-オクタヒドロシクロペンタ[b]ピロール-1-カルボニル]-4-(1-メトキシ-2-メチル-1-オキソプロパン-2-イル)-1,4-ジヒドロピリジン-1-カルボキシラート
  • methyl (4S)-3-[(3aR,6S,6aS)-6-hydroxy-6-phenyl-octahydrocyclopenta[b]pyrrole-1-carbonyl]-4-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1,4-dihydropyridine-1-carboxylate
Other name (1)：
  • (4S)-α,α-Dimethyl-1-(methoxycarbonyl)-3-[[(3aα,6aα)-6β-hydroxy-6-phenyloctahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,4-dihydropyridine-4β-acetic acid methyl ester
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