Chem
J-GLOBAL ID：200907092754118476   Nikkaji number：J1.761.691I

(4S)-α,α-Dimethyl-1-(methoxycarbonyl)-3-[[(3aα,6aα)-6β-hydroxy-6-(2-naphthylmethyl)octahydrocyclopenta[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-(2-ナフチルメチル)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]-1,4-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： C31H36N2O6
Molecular formula furigana： C31-H36-N2-O6
Molecular weight： 532.637
InChI： InChI=1S/C31H36N2O6/c1-30(2,28(35)38-3)25-13-15-32(29(36)39-4)19-24(25)27(34)33-16-12-22-11-14-31(37,26(22)33)18-20-9-10-21-7-5-6-8-23(21)17-20/h5-10,13,15,17,19,22,25-26,37H,11-12,14,16,18H2,1-4H3/t22-,25+,26+,31+/m1/s1
InChI key： IPARUMJAMDBYGV-SFBXWBMZSA-N
SMILES： COC(=O)N1C=C[C@@H](C(=C1)C(=O)N1CC[C@H]2CC[C@](O)(Cc3ccc4ccccc4c3)[C@@H]12)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-(2-ナフチルメチル)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]-1,4-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-[(ナフタレン-2-イル)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]-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-[(naphthalen-2-yl)methyl]-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-(2-naphthylmethyl)octahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,4-dihydropyridine-4β-acetic acid methyl ester
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