Chem
J-GLOBAL ID：200907016828758229   Nikkaji number：J1.430.782F

4-Methyl-7-(Ac-L-Phe-L-Arg-L-Arg-amino)-2H-1-benzopyran-2-one

4-メチル-7-(Ac-L-Phe-L-Arg-L-Arg-アミノ)-2H-1-ベンゾピラン-2-オン
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： C33H44N10O6
Molecular formula furigana： C33-H44-N10-O6
Molecular weight： 676.779
InChI： InChI=1S/C33H44N10O6/c1-19-16-28(45)49-27-18-22(12-13-23(19)27)41-29(46)24(10-6-14-38-32(34)35)42-30(47)25(11-7-15-39-33(36)37)43-31(48)26(40-20(2)44)17-21-8-4-3-5-9-21/h3-5,8-9,12-13,16,18,24-26H,6-7,10-11,14-15,17H2,1-2H3,(H,40,44)(H,41,46)(H,42,47)(H,43,48)(H4,34,35,38)(H4,36,37,39)/t24-,25-,26-/m0/s1
InChI key： ZPISLHCGMUIKGZ-GSDHBNRESA-N
SMILES： CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc2c(C)cc(=O)oc2c1
Systematic name  (3)：
  • 4-メチル-7-(Ac-L-Phe-L-Arg-L-Arg-アミノ)-2H-1-ベンゾピラン-2-オン
  • (2S)-5-カルバムイミドアミド-2-[(2S)-5-カルバムイミドアミド-2-[(2S)-2-アセトアミド-3-フェニルプロパンアミド]ペンタンアミド]-N-(4-メチル-2-オキソ-2H-クロメン-7-イル)ペンタンアミド
  • (2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-acetamido-3-phenylpropanamido]pentanamido]-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamide
Other name (1)：
  • 4-Methyl-7-(Ac-L-Phe-L-Arg-L-Arg-amino)-2H-1-benzopyran-2-one
Thsaurus map：
Thesaurus Map

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