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Chem
J-GLOBAL ID：201707005547316759
Nikkaji number：J3.568.804H (2S)-1-(Benzylsulfonyl)piperidine-2α-carboxylic acid (2S)-1-[(3,4,5-trimethoxybenzoyl)amino]propane-2-yl ester
(2S)-1-(ベンジルスルホニル)ピペリジン-2α-カルボン酸(2S)-1-[(3,4,5-トリメトキシベンゾイル)アミノ]プロパン-2-イル
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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： C26H34N2O8S
Molecular formula furigana： C26-H34-N2-O8-S
Molecular weight： 534.620
InChI：
InChI=1S/C26H34N2O8S/c1-18(16-27-25(29)20-14-22(33-2)24(35-4)23(15-20)34-3)36-26(30)21-12-8-9-13-28(21)37(31,32)17-19-10-6-5-7-11-19/h5-7,10-11,14-15,18,21H,8-9,12-13,16-17H2,1-4H3,(H,27,29)/t18-,21-/m0/s1
InChI key：
UDMLUYFVFKHGIO-RXVVDRJESA-N
SMILES：
COc1cc(cc(OC)c1OC)C(=O)NC[C@H](C)OC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1ccccc1
Systematic name (3)： - (2S)-1-(ベンジルスルホニル)ピペリジン-2α-カルボン酸(2S)-1-[(3,4,5-トリメトキシベンゾイル)アミノ]プロパン-2-イル
- (2S)-1-[(3,4,5-トリメトキシフェニル)ホルムアミド]プロパン-2-イル (2S)-1-フェニルメタンスルホニルピペリジン-2-カルボキシラート
- (2S)-1-[(3,4,5-trimethoxyphenyl)formamido]propan-2-yl (2S)-1-phenylmethanesulfonylpiperidine-2-carboxylate
- (2S)-1-(Benzylsulfonyl)piperidine-2α-carboxylic acid (2S)-1-[(3,4,5-trimethoxybenzoyl)amino]propane-2-yl ester
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