Chem
J-GLOBAL ID：200907029263832009   Nikkaji number：J1.430.774E

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

4-メチル-7-(Ac-L-Phe-L-Arg-L-Lys-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： C33H44N8O6
Molecular formula furigana： C33-H44-N8-O6
Molecular weight： 648.765
InChI： InChI=1S/C33H44N8O6/c1-20-17-29(43)47-28-19-23(13-14-24(20)28)39-30(44)25(11-6-7-15-34)40-31(45)26(12-8-16-37-33(35)36)41-32(46)27(38-21(2)42)18-22-9-4-3-5-10-22/h3-5,9-10,13-14,17,19,25-27H,6-8,11-12,15-16,18,34H2,1-2H3,(H,38,42)(H,39,44)(H,40,45)(H,41,46)(H4,35,36,37)/t25-,26-,27-/m0/s1
InChI key： IXWGKXPCDUXVAZ-QKDODKLFSA-N
SMILES： CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)Nc1ccc2c(C)cc(=O)oc2c1
Systematic name  (3)：
  • 4-メチル-7-(Ac-L-Phe-L-Arg-L-Lys-アミノ)-2H-1-ベンゾピラン-2-オン
  • (2S)-6-アミノ-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)ヘキサンアミド
  • (2S)-6-amino-2-[(2S)-5-carbamimidamido-2-[(2S)-2-acetamido-3-phenylpropanamido]pentanamido]-N-(4-methyl-2-oxo-2H-chromen-7-yl)hexanamide
Other name (1)：
  • 4-Methyl-7-(Ac-L-Phe-L-Arg-L-Lys-amino)-2H-1-benzopyran-2-one
Thsaurus map：
Thesaurus Map

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