Chem
J-GLOBAL ID：200907010154995884   Nikkaji number：J1.430.787G

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

4-メチル-7-(Ac-L-Phe-L-Tyr-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： C36H41N7O7
Molecular formula furigana： C36-H41-N7-O7
Molecular weight： 683.766
InChI： InChI=1S/C36H41N7O7/c1-21-17-32(46)50-31-20-25(12-15-27(21)31)41-33(47)28(9-6-16-39-36(37)38)42-35(49)30(19-24-10-13-26(45)14-11-24)43-34(48)29(40-22(2)44)18-23-7-4-3-5-8-23/h3-5,7-8,10-15,17,20,28-30,45H,6,9,16,18-19H2,1-2H3,(H,40,44)(H,41,47)(H,42,49)(H,43,48)(H4,37,38,39)/t28-,29-,30-/m0/s1
InChI key： ZEHMWGGFZYRRGV-DTXPUJKBSA-N
SMILES： CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)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-Tyr-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)-2-[(2S)-2-アセトアミド-3-フェニルプロパンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]-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)-2-[(2S)-2-acetamido-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamide
Other name (1)：
  • 4-Methyl-7-(Ac-L-Phe-L-Tyr-L-Arg-amino)-2H-1-benzopyran-2-one
Thsaurus map：
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