Chem
J-GLOBAL ID：200907064336597313
Nikkaji number：J1.761.695A
(2S)-α,α-Dimethyl-1-(methoxycarbonyl)-5-[[(3aα,6aα)-6β-hydroxy-6-benzyloctahydrocyclopenta[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-ベンジ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 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
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
Molecular formula： C27H34N2O6
Molecular formula furigana： C27-H34-N2-O6
Molecular weight： 482.577
InChI：
InChI=1S/C27H34N2O6/c1-26(2,24(31)34-3)21-11-10-20(17-29(21)25(32)35-4)23(30)28-15-13-19-12-14-27(33,22(19)28)16-18-8-6-5-7-9-18/h5-11,17,19,21-22,33H,12-16H2,1-4H3/t19-,21+,22+,27+/m1/s1
InChI key：
PREHZYQCGHZJII-JZWGJFHDSA-N
SMILES：
COC(=O)N1C=C(C=C[C@H]1C(C)(C)C(=O)OC)C(=O)N1CC[C@H]2CC[C@](O)(Cc3ccccc3)[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-ベンジ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,6S,6aS)-6-ベンジル-6-ヒドロキシ-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,6S,6aS)-6-benzyl-6-hydroxy-octahydrocyclopenta[b]pyrrole-1-carbonyl]-2-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1,2-dihydropyridine-1-carboxylate
- (2S)-α,α-Dimethyl-1-(methoxycarbonyl)-5-[[(3aα,6aα)-6β-hydroxy-6-benzyloctahydrocyclopenta[b]pyrrole-1-yl]carbonyl]-1,2-dihydropyridine-2α-acetic acid methyl ester
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