Chem
J-GLOBAL ID：200907054030515571   Nikkaji number：J515.479K

N-[(2S)-2-[3α-[[N-(5-Aminopentanoyl)-L-Phe-L-Phe-]amino]-2-oxo-1-pyrrolidinyl]-4-methylpentanoyl]-L-Met-NH2

N-[(2S)-2-[3α-[[N-(5-アミノペンタノイル)-L-Phe-L-Phe-]アミノ]-2-オキソ-1-ピロリジニル]-4-メチルペンタノイル]-L-Met-NH2
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： C38H55N7O6S
Molecular formula furigana： C38-H55-N7-O6-S
Molecular weight： 737.960
InChI： InChI=1S/C38H55N7O6S/c1-25(2)22-32(37(50)42-28(34(40)47)18-21-52-3)45-20-17-29(38(45)51)43-36(49)31(24-27-14-8-5-9-15-27)44-35(48)30(23-26-12-6-4-7-13-26)41-33(46)16-10-11-19-39/h4-9,12-15,25,28-32H,10-11,16-24,39H2,1-3H3,(H2,40,47)(H,41,46)(H,42,50)(H,43,49)(H,44,48)/t28-,29+,30-,31-,32-/m0/s1
InChI key： YHTHZLNINQWFCI-RTMXLORFSA-N
SMILES： CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(=O)N
Systematic name  (3)：
  • N-[(2S)-2-[3α-[[N-(5-アミノペンタノイル)-L-Phe-L-Phe-]アミノ]-2-オキソ-1-ピロリジニル]-4-メチルペンタノイル]-L-Met-NH2
  • (2S)-2-[(3R)-3-[(2S)-2-[(2S)-2-(5-アミノペンタンアミド)-3-フェニルプロパンアミド]-3-フェニルプロパンアミド]-2-オキソピロリジン-1-イル]-N-[(1S)-1-カルバモイル-3-(メチルスルファニル)プロピル]-4-メチルペンタンアミド
  • (2S)-2-[(3R)-3-[(2S)-2-[(2S)-2-(5-aminopentanamido)-3-phenylpropanamido]-3-phenylpropanamido]-2-oxopyrrolidin-1-yl]-N-[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]-4-methylpentanamide
Other name (1)：
  • N-[(2S)-2-[3α-[[N-(5-Aminopentanoyl)-L-Phe-L-Phe-]amino]-2-oxo-1-pyrrolidinyl]-4-methylpentanoyl]-L-Met-NH2
Thsaurus map：
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