Chem
J-GLOBAL ID：201607009130827759   Nikkaji number：J3.511.214F

WEHI-842

(3S,4S)-N-フェネチル-3-ヒドロキシ-4-[[N-(ベンジルオキシカルボニル)-3-(アミジノアミノオキシメチル)-L-Ala-L-Val-]アミノ]-6-メチルヘプタンアミド
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： C34H51N7O7
Molecular formula furigana： C34-H51-N7-O7
Molecular weight： 669.824
InChI： InChI=1S/C34H51N7O7/c1-22(2)19-27(28(42)20-29(43)37-17-15-24-11-7-5-8-12-24)38-32(45)30(23(3)4)40-31(44)26(16-18-48-41-33(35)36)39-34(46)47-21-25-13-9-6-10-14-25/h5-14,22-23,26-28,30,42H,15-21H2,1-4H3,(H,37,43)(H,38,45)(H,39,46)(H,40,44)(H4,35,36,41)/t26-,27-,28-,30-/m0/s1
InChI key： VAHRPHLZONNTFF-NUISNXNRSA-N
SMILES： CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCONC(=N)N)NC(=O)OCc1ccccc1)C(C)C)[C@@H](O)CC(=O)NCCc1ccccc1
Systematic name  (3)：
  • (3S,4S)-N-フェネチル-3-ヒドロキシ-4-[[N-(ベンジルオキシカルボニル)-3-(アミジノアミノオキシメチル)-L-Ala-L-Val-]アミノ]-6-メチルヘプタンアミド
  • ベンジル N-[(1S)-3-(カルバムイミドアミドオキシ)-1-{[(1S)-1-{[(2S,3S)-2-ヒドロキシ-5-メチル-1-[(2-フェニルエチル)カルバモイル]ヘキサン-3-イル]カルバモイル}-2-メチルプロピル]カルバモイル}プロピル]カルバマート
  • benzyl N-[(1S)-3-(carbamimidamidooxy)-1-{[(1S)-1-{[(2S,3S)-2-hydroxy-5-methyl-1-[(2-phenylethyl)carbamoyl]hexan-3-yl]carbamoyl}-2-methylpropyl]carbamoyl}propyl]carbamate
Other name (2)：
  • (3S,4S)-N-Phenethyl-3-hydroxy-4-[[N-(benzyloxycarbonyl)-3-(amidinoaminooxymethyl)-L-Ala-L-Val-]amino]-6-methylheptanamide
  • WEHI-842
Thsaurus map：
Thesaurus Map

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