Chem
J-GLOBAL ID：200907014195178128   Nikkaji number：J1.430.792C

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

4-メチル-7-(Ac-L-Phe-L-Pro-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： C32H39N7O6
Molecular formula furigana： C32-H39-N7-O6
Molecular weight： 617.707
InChI： InChI=1S/C32H39N7O6/c1-19-16-28(41)45-27-18-22(12-13-23(19)27)37-29(42)24(10-6-14-35-32(33)34)38-30(43)26-11-7-15-39(26)31(44)25(36-20(2)40)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,36,40)(H,37,42)(H,38,43)(H4,33,34,35)/t24-,25-,26-/m0/s1
InChI key： RCDJMEAICNZQPF-GSDHBNRESA-N
SMILES： CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=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-Pro-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)-1-[(2S)-2-アセトアミド-3-フェニルプロパノイル]ピロリジン-2-イル]ホルムアミド}-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)-1-[(2S)-2-acetamido-3-phenylpropanoyl]pyrrolidin-2-yl]formamido}-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamide
Other name (1)：
  • 4-Methyl-7-(Ac-L-Phe-L-Pro-L-Arg-amino)-2H-1-benzopyran-2-one
Thsaurus map：
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