Chem
J-GLOBAL ID：200907020195753912   Nikkaji number：J640.003E

1-[N-[(2,3,6-Trimethyl-4-methoxyphenyl)sulfonyl]-L-Asp-4-amidino-D-Phe-]piperidine

1-[N-[(2,3,6-トリメチル-4-メトキシフェニル)スルホニル]-L-Asp-4-アミジノ-D-Phe-]ピペリジン
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： C29H39N5O7S
Molecular formula furigana： C29-H39-N5-O7-S
Molecular weight： 601.720
InChI： InChI=1S/C29H39N5O7S/c1-17-14-24(41-4)18(2)19(3)26(17)42(39,40)33-22(16-25(35)36)28(37)32-23(29(38)34-12-6-5-7-13-34)15-20-8-10-21(11-9-20)27(30)31/h8-11,14,22-23,33H,5-7,12-13,15-16H2,1-4H3,(H3,30,31)(H,32,37)(H,35,36)/t22-,23+/m0/s1
InChI key： ZOXOKTJHZSUHRJ-XZOQPEGZSA-N
SMILES： COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(cc1)C(=N)N)C(=O)N1CCCCC1
Systematic name  (5)：
  • 1-[N-[(2,3,6-トリメチル-4-メトキシフェニル)スルホニル]-L-Asp-4-アミジノ-D-Phe-]ピペリジン
  • (3S)-3-[(2,3,6-トリメチル-4-メトキシフェニル)スルホニルアミノ]-4-[[(1R)-1-[4-(アミノイミノメチル)ベンジル]-2-オキソ-2-(1-ピペリジニル)エチル]アミノ]-4-オキソ酪酸
  • 1-[N-[N-(2,3,6-トリメチル-4-メトキシフェニルスルホニル)-3-カルボキシ-L-アラニル]-4-(アミノイミノメチル)-D-フェニルアラニル]ピペリジン
  • (3S)-3-{[(2R)-3-(4-カルバムイミドイルフェニル)-1-オキソ-1-(ピペリジン-1-イル)プロパン-2-イル]カルバモイル}-3-(4-メトキシ-2,3,6-トリメチルベンゼンスルホンアミド)プロパン酸
  • (3S)-3-{[(2R)-3-(4-carbamimidoylphenyl)-1-oxo-1-(piperidin-1-yl)propan-2-yl]carbamoyl}-3-(4-methoxy-2,3,6-trimethylbenzenesulfonamido)propanoic acid
Other name (3)：
  • (3S)-3-[(2,3,6-Trimethyl-4-methoxyphenyl)sulfonylamino]-4-[[(1R)-1-[4-(aminoiminomethyl)benzyl]-2-oxo-2-(1-piperidinyl)ethyl]amino]-4-oxobutyric acid
  • 1-[N-[N-(2,3,6-Trimethyl-4-methoxyphenylsulfonyl)-3-carboxy-L-alanyl]-4-(aminoiminomethyl)-D-phenylalanyl]piperidine
  • 1-[N-[(2,3,6-Trimethyl-4-methoxyphenyl)sulfonyl]-L-Asp-4-amidino-D-Phe-]piperidine
Thsaurus map：
Thesaurus Map

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