Chem
J-GLOBAL ID：200907074676473622   Nikkaji number：J357.365F

N-[(S)-2-[[(R)-1-[(Isovaleryl-L-Val-L-Val-)amino]-3-methylbutyl]phosphonyloxy]-3-phenylpropionyl]-L-Ala-L-Ala-OMe

N-[(S)-2-[[(R)-1-[(イソバレリル-L-Val-L-Val-)アミノ]-3-メチルブチル]ホスホニルオキシ]-3-フェニルプロピオニル]-L-Ala-L-Ala-OMe
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： C36H60N5O10P
Molecular formula furigana： C36-H60-N5-O10-P
Molecular weight： 753.875
InChI： InChI=1S/C36H60N5O10P/c1-20(2)17-28(42)39-30(22(5)6)35(46)41-31(23(7)8)34(45)40-29(18-21(3)4)52(48,49)51-27(19-26-15-13-12-14-16-26)33(44)37-24(9)32(43)38-25(10)36(47)50-11/h12-16,20-25,27,29-31H,17-19H2,1-11H3,(H,37,44)(H,38,43)(H,39,42)(H,40,45)(H,41,46)(H,48,49)/t24-,25-,27-,29+,30-,31-/m0/s1
InChI key： CEPZPGMVMASQKU-ORDNGIEBSA-N
SMILES： COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)OP(=O)(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
Systematic name  (3)：
  • N-[(S)-2-[[(R)-1-[(イソバレリル-L-Val-L-Val-)アミノ]-3-メチルブチル]ホスホニルオキシ]-3-フェニルプロピオニル]-L-Ala-L-Ala-OMe
  • [(1S)-1-{[(1S)-1-{[(2S)-1-メトキシ-1-オキソプロパン-2-イル]カルバモイル}エチル]カルバモイル}-2-フェニルエトキシ][(1R)-3-メチル-1-[(2S)-3-メチル-2-[(2S)-3-メチル-2-(3-メチルブタンアミド)ブタンアミド]ブタンアミド]ブチル]ホスフィン酸
  • [(1S)-1-{[(1S)-1-{[(2S)-1-methoxy-1-oxopropan-2-yl]carbamoyl}ethyl]carbamoyl}-2-phenylethoxy][(1R)-3-methyl-1-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]butyl]phosphinic acid
Other name (1)：
  • N-[(S)-2-[[(R)-1-[(Isovaleryl-L-Val-L-Val-)amino]-3-methylbutyl]phosphonyloxy]-3-phenylpropionyl]-L-Ala-L-Ala-OMe
Thsaurus map：
Thesaurus Map

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